Exact Mass: 456.1752542

Exact Mass Matches: 456.1752542

Found 500 metabolites which its exact mass value is equals to given mass value 456.1752542, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

5,10-Methenyl-tetrahydrofolate

5,10-Methenyl-tetrahydrofolate

C20H22N7O6+ (456.1631492)


   

Delavirdine

1-(3-((1-Methylethyl)amino)-2-pyridinyl)-4-((5-((methylsulphonyl)amino)-1H-indol-2-yl)carbonyl)piperazine

C22H28N6O3S (456.19434980000005)


Delavirdine is only found in individuals that have used or taken this drug. It is a potent, non-nucleoside reverse transcriptase inhibitor with activity specific for HIV-1. [PubChem]Delavirdine binds directly to viral reverse transcriptase (RT) and blocks the RNA-dependent and DNA-dependent DNA polymerase activities by disrupting the enzymes catalytic site. J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AG - Non-nucleoside reverse transcriptase inhibitors C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97453 - Non-nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent

   

Atrovirinone

Methyl 2,4-dihydroxy-6-{[2-methoxy-4,5-bis(3-methylbut-2-en-1-yl)-3,6-dioxocyclohexa-1,4-dien-1-yl]oxy}benzoic acid

C25H28O8 (456.1784088)


Atrovirinone is found in fruits. Atrovirinone is a constituent of the roots of Garcinia atroviridis (gelugor) Constituent of the roots of Garcinia atroviridis (gelugor). Atrovirinone is found in fruits.

   

3-Hydroxymethyl-picumast

7-(3-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}propoxy)-3-(hydroxymethyl)-4-methyl-2H-chromen-2-one

C25H29ClN2O4 (456.18157440000004)


   

Indoxam

2-{[3-({[1,1-biphenyl]-2-yl}methyl)-1-(carbamoylcarbonyl)-2-ethylindolizin-8-yl]oxy}acetic acid

C27H24N2O5 (456.1685134)


   

3-Isopropyl-5-(4-(((6-(4-(methylsulfonyl)phenyl)pyridin-3-yl)oxy)methyl)piperidin-1-yl)-1,2,4-oxadiazole

3-Isopropyl-5-(4-(((6-(4-(methylsulfonyl)phenyl)pyridin-3-yl)oxy)methyl)piperidin-1-yl)-1,2,4-oxadiazole

C23H28N4O4S (456.18311680000005)


   

Lactupicrin methyl ester

Methyl 2-[4-hydroxy-3-(hydroxymethyl)-6-{[2-(4-hydroxyphenyl)acetyl]oxy}-6,8-dimethyl-1-oxo-1,3a,4,5,6,7-hexahydroazulen-5-yl]prop-2-enoic acid

C25H28O8 (456.1784088)


Lactupicrin methyl ester is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Lactupicrin methyl ester can be found in chicory, which makes lactupicrin methyl ester a potential biomarker for the consumption of this food product.

   

2,15-dioxapentacyclo[22.2.2.13,7.110,14.016,21]triaconta-1(26),3(30),4,6,10(29),11,13,16(21),17,19,24,27-dodecaene-4,5,8,17-tetrol 1

2,15-dioxapentacyclo[22.2.2.13,7.110,14.016,21]triaconta-1(26),3(30),4,6,10(29),11,13,16(21),17,19,24,27-dodecaene-4,5,8,17-tetrol 1

C28H24O6 (456.1572804)


CONFIDENCE Predicted

   

14-Hydroxyperrottetin E 11-methyl ether

14-Hydroxyperrottetin E 11-methyl ether

C29H28O5 (456.1936638)


   

Kopsamine

(-)-N-Methoxycarbonyl-11,12-methylenedioxy-kopsinaline

C24H28N2O7 (456.1896418)


   
   
   
   
   
   
   
   
   
   

Lupinisoflavone M

Lupinisoflavone M

C25H28O8 (456.1784088)


   

2,6-Bis(4-hydroxybenzyl)-3,3-dihydroxy-5-methoxybibenzyl

2,6-Bis(4-hydroxybenzyl)-3,3-dihydroxy-5-methoxybibenzyl

C29H28O5 (456.1936638)


   
   
   
   
   

aspernigrin B

aspernigrin B

C27H24N2O5 (456.1685134)


A pyridine alkaloid with formula C27H24N2O5 that is isolated from Aspergillus niger and displays neuroprotective protperties.

   

Lobaric acid

Lobaric acid

C25H28O8 (456.1784088)


D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates

   

2-[3,5-Dimethoxy-4-[(3-methyl-2-butenyl)oxy]phenyl]-5,6,7-trimethoxy-4H-1-benzopyran-4-one

2-[3,5-Dimethoxy-4-[(3-methyl-2-butenyl)oxy]phenyl]-5,6,7-trimethoxy-4H-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

3,5,8,3,4-Pentamethoxy-7-prenyloxyflavone

3,5,8,3,4-Pentamethoxy-7-prenyloxyflavone

C25H28O8 (456.1784088)


   

Kushenol G

3,5,7,2,4-Pentahydroxy-8- (5-hydroxy-2-isopropenyl-5-methylhexyl) flavone

C25H28O8 (456.1784088)


   
   
   

N-Fructosyl glutamylphenylalanine

N-Fructosyl glutamylphenylalanine

C20H28N2O10 (456.1743868)


Annotation level-3

   

Propoxyl oxokadsurane

Propoxyl oxokadsurane

C25H28O8 (456.1784088)


   

(2R,3R)-3,3,4,5,7-tetrahydroxy-3-methoxy-6-[6-hydroxy-3,7-dimethyl-2(E),7-octadienyl]flavanone

(2R,3R)-3,3,4,5,7-tetrahydroxy-3-methoxy-6-[6-hydroxy-3,7-dimethyl-2(E),7-octadienyl]flavanone

C25H28O8 (456.1784088)


   

4-[2-(3-Methoxyphenyl)ethyl]-2-[4-[2-(2,5-dihydroxyphenyl)ethyl]phenoxy]phenol

4-[2-(3-Methoxyphenyl)ethyl]-2-[4-[2-(2,5-dihydroxyphenyl)ethyl]phenoxy]phenol

C29H28O5 (456.1936638)


   
   

Prasanthalin|prasanthaline

Prasanthalin|prasanthaline

C25H28O8 (456.1784088)


   
   

alpha-Pyranose-alpha-L-Rhamnopyranosyl-(1鈥樏傗垎3)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎3)-L-rhamnose|beta-Pyranose-alpha-D-Rhamnopyranosyl-(1鈥樏傗垎3)-alpha-D-rhamnopyranosyl-(1鈥樏傗垎2)-L-rhamnose

alpha-Pyranose-alpha-L-Rhamnopyranosyl-(1鈥樏傗垎3)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎3)-L-rhamnose|beta-Pyranose-alpha-D-Rhamnopyranosyl-(1鈥樏傗垎3)-alpha-D-rhamnopyranosyl-(1鈥樏傗垎2)-L-rhamnose

C18H32O13 (456.1842822)


   

11a-hydroxy-7,8-dimethoxy-13-methyl-1a,2,3a,4,9c,9d,11,11a-octahydro-5h,10h-9b,11b-(ethanoiminomethano)-1,3-dioxa-5a-azacyclopropa[4,5]cyclohepta[1,2,3-cd]fluoranthene-5,10-dione

11a-hydroxy-7,8-dimethoxy-13-methyl-1a,2,3a,4,9c,9d,11,11a-octahydro-5h,10h-9b,11b-(ethanoiminomethano)-1,3-dioxa-5a-azacyclopropa[4,5]cyclohepta[1,2,3-cd]fluoranthene-5,10-dione

C24H28N2O7 (456.1896418)


   

Dehydroaustinol

Dehydroaustinol

C25H28O8 (456.1784088)


A meroterpenoid produced by Aspergillus nidulans. It has an oxygen-bridged pentacyclic structure which incorporates three lactone functionalities and a spiro union.

   

3,3,4,5,8-Penta-Me ether,7-O-(3-methyl-2-butenyl)-Gossypetin

3,3,4,5,8-Penta-Me ether,7-O-(3-methyl-2-butenyl)-Gossypetin

C25H28O8 (456.1784088)


   
   
   
   
   
   
   
   

6,7-dimethylbenzofuran-5-yl beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranoside

6,7-dimethylbenzofuran-5-yl beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranoside

C21H28O11 (456.16315380000003)


   
   

trans-epsilon-viniferin

trans-epsilon-viniferin

C28H24O6 (456.1572804)


   

alpha-D-Rhamnopyranosyl-(1鈥樏傗垎2)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎3)-L-rhamnose|alpha-L-Rhamnopyranosyl-(1鈥樏傗垎2)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎3)-L-rhamnose

alpha-D-Rhamnopyranosyl-(1鈥樏傗垎2)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎3)-L-rhamnose|alpha-L-Rhamnopyranosyl-(1鈥樏傗垎2)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎3)-L-rhamnose

C18H32O13 (456.1842822)


   
   

8-(7??-hydroxy-3??,7??-dimethyl-oct-2??-enyl)quercetin|solophenol C

8-(7??-hydroxy-3??,7??-dimethyl-oct-2??-enyl)quercetin|solophenol C

C25H28O8 (456.1784088)


   
   

2-(7??-hydroxy-3??,7??-dimethyl-oct-2??-enyl)quercetin|solophenol B

2-(7??-hydroxy-3??,7??-dimethyl-oct-2??-enyl)quercetin|solophenol B

C25H28O8 (456.1784088)


   
   
   
   
   
   
   
   

6alpha-angeloyloxy-1-oxo-2,3-dihydrosalviarin

6alpha-angeloyloxy-1-oxo-2,3-dihydrosalviarin

C25H28O8 (456.1784088)


   

3-methyl-O-[alpha-arabinopyranosyl-(1->6)-beta-glucopyranosyl]-6-methyl-benzofuran

3-methyl-O-[alpha-arabinopyranosyl-(1->6)-beta-glucopyranosyl]-6-methyl-benzofuran

C21H28O11 (456.16315380000003)


   

1alpha,9beta-difuranoyloxy-2-oxodihydro-beta-agarofuran

1alpha,9beta-difuranoyloxy-2-oxodihydro-beta-agarofuran

C25H28O8 (456.1784088)


   
   

3,3-Dimethoxy-2,4-diacetoxy-5-(3-acetoxy-propyl)-stilben|trans-2,4-diacetoxy-5-(3-acetoxypropyl)-3,3-dimethoxystilbene

3,3-Dimethoxy-2,4-diacetoxy-5-(3-acetoxy-propyl)-stilben|trans-2,4-diacetoxy-5-(3-acetoxypropyl)-3,3-dimethoxystilbene

C25H28O8 (456.1784088)


   

Dichotine, acetate (ester)

Dichotine, acetate (ester)

C24H28N2O7 (456.1896418)


   

cedrusinin triacetate

cedrusinin triacetate

C25H28O8 (456.1784088)


   

(1S,3aR,4S,9aR)-4-(4-acetoxy-3-methoxyphenyl)-1,7-dimethoxy-1,3,3a,4,9,9a-hexahydronaphtho<2,3-c>furan-6-yl acetate|formosanol diacetate|Methyl-alpha-conidendraldiacetat|tsugacetal diacetate

(1S,3aR,4S,9aR)-4-(4-acetoxy-3-methoxyphenyl)-1,7-dimethoxy-1,3,3a,4,9,9a-hexahydronaphtho<2,3-c>furan-6-yl acetate|formosanol diacetate|Methyl-alpha-conidendraldiacetat|tsugacetal diacetate

C25H28O8 (456.1784088)


   

2(S)-5,6,7-trihydroxy-5-prenyl-[2,2-(3,4-dihydroxy)-dimethylpyrano]-(5,6:3,4)flavanone

2(S)-5,6,7-trihydroxy-5-prenyl-[2,2-(3,4-dihydroxy)-dimethylpyrano]-(5,6:3,4)flavanone

C25H28O8 (456.1784088)


   
   

alpha-Pyranose-alpha-L-Rhamnopyranosyl-(1鈥樏傗垎3)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎2)-L-rhamnose

alpha-Pyranose-alpha-L-Rhamnopyranosyl-(1鈥樏傗垎3)-alpha-L-rhamnopyranosyl-(1鈥樏傗垎2)-L-rhamnose

C18H32O13 (456.1842822)


   
   
   
   

lactupicrin methyl ester

lactupicrin methyl ester

C25H28O8 (456.1784088)


   
   

Asp Ala His Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]propanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

9-keto Fluprostenol

(±)-9-oxo-11α,15R-dihydroxy-16-(3-(trifluoromethyl)phenoxy)-17,18,19,20-tetranor-prosta-5Z,13E-dien-1-oic acid

C23H27F3O6 (456.17596380000003)


   

PF-3845

N-3-Pyridinyl-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methyl]-1-piperidinecarboxamide

C24H23F3N4O2 (456.1773014)


PF-3845 is a potent, selective, irreversible and orally active inhibitor of fatty acid amide hydrolase (FAAH), with a Ki of 0.23 μM. PF-3845 is a covalent inhibitor that carbamylates FAAH's serine nucleophile. PF-3845 can reduce pain sensation, inflammation, and anxiety/depression without substantial effects on motility or cognition[1][3].

   
   
   
   
   
   

11-keto Fluprostenol

11-oxo-9α,15R-dihydroxy-16-(3-(trifluoromethyl)phenoxy)-17,18,19,20-tetranor-prosta-5Z,13E-dien-1-oic acid

C23H27F3O6 (456.17596380000003)


   
   

LOBARIC ACID

NCGC00160140-01!LOBARIC ACID

C25H28O8 (456.1784088)


   

6-[2,3-dihydroxy-3-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-7-methoxychromen-2-one

NCGC00385631-01!6-[2,3-dihydroxy-3-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-7-methoxychromen-2-one

C21H28O11 (456.16315380000003)


   

C25H28O8_(1S,2R,3R,7R,8R,9S,13R)-8-Hydroxy-2,2,2,9,13-pentamethyl-6,16-bis(methylene)-6H-spiro[pyran-3,5-[10,14,17]trioxapentacyclo[7.6.1.1~7,12~.0~1,12~.0~2,7~]heptadecane]-6,11,15-trione

NCGC00179938-02_C25H28O8_(1S,2R,3R,7R,8R,9S,13R)-8-Hydroxy-2,2,2,9,13-pentamethyl-6,16-bis(methylene)-6H-spiro[pyran-3,5-[10,14,17]trioxapentacyclo[7.6.1.1~7,12~.0~1,12~.0~2,7~]heptadecane]-6,11,15-trione

C25H28O8 (456.1784088)


   

C25H28O8_12H-6,13-Epoxy-8,12a-methano-2H,7H-furo[3,4:6,7]oxireno[3,4]heptaleno[3,2-c]pyran-4,9,12(6H,8H)-trione, 6a,9a,10,12b,13,13a-hexahydro-9a-hydroxy-2,2,6,8,10,12b-hexamethyl-15-methylene

NCGC00347648-02_C25H28O8_12H-6,13-Epoxy-8,12a-methano-2H,7H-furo[3,4:6,7]oxireno[3,4]heptaleno[3,2-c]pyran-4,9,12(6H,8H)-trione, 6a,9a,10,12b,13,13a-hexahydro-9a-hydroxy-2,2,6,8,10,12b-hexamethyl-15-methylene-

C25H28O8 (456.1784088)


   

2-[3,4-dihydroxy-2,2-dimethyl-8-(3-methylbut-2-enoxy)-3,4-dihydrochromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

2-[3,4-dihydroxy-2,2-dimethyl-8-(3-methylbut-2-enoxy)-3,4-dihydrochromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

C25H28O8 (456.1784088)


   

7-hydroxy-2,6,9,12,17,17-hexamethyl-22-methylidene-5,16,19,21-tetraoxaheptacyclo[10.8.1.1³,⁹.0²,¹¹.0³,⁷.0¹³,¹⁸.0¹⁸,²⁰]docos-13-ene-4,8,15-trione

7-hydroxy-2,6,9,12,17,17-hexamethyl-22-methylidene-5,16,19,21-tetraoxaheptacyclo[10.8.1.1³,⁹.0²,¹¹.0³,⁷.0¹³,¹⁸.0¹⁸,²⁰]docos-13-ene-4,8,15-trione

C25H28O8 (456.1784088)


   

2,15-dioxapentacyclo[22.2.2.13,7.110,14.016,21]triaconta-1(26),3(30),4,6,10(29),11,13,16(21),17,19,24,27-dodecaene-4,5,8,17-tetrol 2

2,15-dioxapentacyclo[22.2.2.13,7.110,14.016,21]triaconta-1(26),3(30),4,6,10(29),11,13,16(21),17,19,24,27-dodecaene-4,5,8,17-tetrol 2

C28H24O6 (456.1572804)


CONFIDENCE Predicted

   
   

Clindamycin sulfoxide N-oxide

Clindamycin sulfoxide N-oxide

C18H33ClN2O7S (456.1696898)


   

7-hydroxy-2,6,9,12,17,17-hexamethyl-22-methylidene-5,16,19,21-tetraoxaheptacyclo[10.8.1.1³,⁹.0²,¹¹.0³,⁷.0¹³,¹⁸.0¹⁸,²⁰]docos-13-ene-4,8,15-trione_major

7-hydroxy-2,6,9,12,17,17-hexamethyl-22-methylidene-5,16,19,21-tetraoxaheptacyclo[10.8.1.1³,⁹.0²,¹¹.0³,⁷.0¹³,¹⁸.0¹⁸,²⁰]docos-13-ene-4,8,15-trione_major

C25H28O8 (456.1784088)


   

2-[3,4-dihydroxy-2,2-dimethyl-8-(3-methylbut-2-enoxy)-3,4-dihydrochromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one_major

2-[3,4-dihydroxy-2,2-dimethyl-8-(3-methylbut-2-enoxy)-3,4-dihydrochromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one_major

C25H28O8 (456.1784088)


   

7-hydroxy-2,6,9,12,17,17-hexamethyl-22-methylidene-5,16,19,21-tetraoxaheptacyclo[10.8.1.1³,?.0²,¹¹.0³,?.0¹³,¹?.0¹?,²?]docos-13-ene-4,8,15-trione

7-hydroxy-2,6,9,12,17,17-hexamethyl-22-methylidene-5,16,19,21-tetraoxaheptacyclo[10.8.1.1³,?.0²,¹¹.0³,?.0¹³,¹?.0¹?,²?]docos-13-ene-4,8,15-trione

C25H28O8 (456.1784088)


   

Ala Cys Thr Tyr

(2S)-2-[(2S,3R)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Ala Cys Tyr Thr

(2S,3R)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Ala Asp Asp His

(3S)-3-[(2S)-2-[(2S)-2-aminopropanamido]-3-carboxypropanamido]-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C17H24N6O9 (456.1604694)


   

Ala Asp His Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

Ala Glu His Thr

(4S)-4-[(2S)-2-aminopropanamido]-4-{[(1S)-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Ala Glu Thr His

(4S)-4-[(2S)-2-aminopropanamido]-4-{[(1S,2R)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Ala His Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

Ala His Glu Thr

(4S)-4-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-imidazol-4-yl)propanamido]-4-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Ala His Thr Glu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]pentanedioic acid

C18H28N6O8 (456.1968528)


   

Ala Thr Cys Tyr

(2S)-2-[(2R)-2-[(2S,3R)-2-[(2S)-2-aminopropanamido]-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Ala Thr Glu His

(4S)-4-[(2S,3R)-2-[(2S)-2-aminopropanamido]-3-hydroxybutanamido]-4-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Ala Thr His Glu

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-aminopropanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C18H28N6O8 (456.1968528)


   

Ala Thr Tyr Cys

(2R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-aminopropanamido]-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Ala Tyr Cys Thr

(2S,3R)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Ala Tyr Thr Cys

(2R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Cys Ala Thr Tyr

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Cys Ala Tyr Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Cys Phe Ser Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-hydroxypropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Cys Phe Thr Ser

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-hydroxybutanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Cys His Pro Thr

(2S,3R)-2-{[(2S)-1-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-hydroxybutanoic acid

C18H28N6O6S (456.17909480000003)


   

Cys His Thr Pro

(2S)-1-[(2S,3R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

C18H28N6O6S (456.17909480000003)


   

Cys Pro His Thr

(2S,3R)-2-[(2S)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanoic acid

C18H28N6O6S (456.17909480000003)


   

Cys Pro Thr His

(2S)-2-[(2S,3R)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanoic acid

C18H28N6O6S (456.17909480000003)


   

Cys Ser Phe Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-phenylpropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Cys Ser Thr Phe

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-hydroxybutanamido]-3-phenylpropanoic acid

C19H28N4O7S (456.1678618)


   

Cys Thr Ala Tyr

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanamido]propanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Cys Thr Phe Ser

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-phenylpropanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Cys Thr His Pro

(2S)-1-[(2S)-2-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C18H28N6O6S (456.17909480000003)


   

Cys Thr Pro His

(2S)-2-{[(2S)-1-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanoic acid

C18H28N6O6S (456.17909480000003)


   

Cys Thr Ser Phe

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-hydroxypropanamido]-3-phenylpropanoic acid

C19H28N4O7S (456.1678618)


   

Cys Thr Tyr Ala

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]propanoic acid

C19H28N4O7S (456.1678618)


   

Cys Tyr Ala Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]propanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Cys Tyr Thr Ala

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]propanoic acid

C19H28N4O7S (456.1678618)


   

Asp Ala Asp His

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]propanamido]-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C17H24N6O9 (456.1604694)


   

Asp Asp Ala His

(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C17H24N6O9 (456.1604694)


   

Asp Asp His Ala

(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C17H24N6O9 (456.1604694)


   

Asp Glu Gly His

(4S)-4-[(2S)-2-amino-3-carboxypropanamido]-4-[({[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}methyl)carbamoyl]butanoic acid

C17H24N6O9 (456.1604694)


   

Asp Glu His Gly

(4S)-4-[(2S)-2-amino-3-carboxypropanamido]-4-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

Asp Glu Pro Pro

(2S)-1-{[(2S)-1-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carboxybutanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidine-2-carboxylic acid

C19H28N4O9 (456.18561980000004)


   

Asp Gly Glu His

(4S)-4-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-4-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

Asp Gly His Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C17H24N6O9 (456.1604694)


   

Asp His Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]propanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

Asp His Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C17H24N6O9 (456.1604694)


   

Asp His Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C17H24N6O9 (456.1604694)


   

Asp His Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}pentanedioic acid

C17H24N6O9 (456.1604694)


   

Asp His Ser Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]-3-methylbutanoic acid

C18H28N6O8 (456.1968528)


   

Asp His Val Ser

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-methylpropyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Asp Pro Glu Pro

(2S)-1-[(2S)-2-{[(2S)-1-[(2S)-2-amino-3-carboxypropanoyl]pyrrolidin-2-yl]formamido}-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid

C19H28N4O9 (456.18561980000004)


   

Asp Pro Pro Glu

(2S)-2-{[(2S)-1-{[(2S)-1-[(2S)-2-amino-3-carboxypropanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}pentanedioic acid

C19H28N4O9 (456.18561980000004)


   

Asp Ser His Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanoic acid

C18H28N6O8 (456.1968528)


   

Asp Ser Val His

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-methylpropyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Asp Val His Ser

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Asp Val Ser His

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

8-hydroxymianserin glucuronide

8-hydroxymianserin glucuronide

C24H28N2O7 (456.1896418)


   

Glu Ala His Thr

(4S)-4-amino-4-{[(1S)-1-{[(1S)-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Glu Ala Thr His

(4S)-4-amino-4-{[(1S)-1-{[(1S,2R)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Glu Asp Gly His

(4S)-4-amino-4-{[(1S)-2-carboxy-1-[({[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}methyl)carbamoyl]ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

Glu Asp His Gly

(4S)-4-amino-4-{[(1S)-2-carboxy-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

Glu Asp Pro Pro

(2S)-1-{[(2S)-1-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-carboxypropanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidine-2-carboxylic acid

C19H28N4O9 (456.18561980000004)


   

Glu Gly Asp His

(4S)-4-amino-4-[({[(1S)-2-carboxy-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}methyl)carbamoyl]butanoic acid

C17H24N6O9 (456.1604694)


   

Glu Gly His Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-carboxybutanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

Glu His Ala Thr

(4S)-4-amino-4-{[(1S)-1-{[(1S)-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}ethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Glu His Asp Gly

(4S)-4-amino-4-{[(1S)-1-{[(1S)-2-carboxy-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

Glu His Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}butanedioic acid

C17H24N6O9 (456.1604694)


   

Glu His Thr Ala

(4S)-4-amino-4-{[(1S)-1-{[(1S,2R)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Glu Pro Asp Pro

(2S)-1-[(2S)-2-{[(2S)-1-[(2S)-2-amino-4-carboxybutanoyl]pyrrolidin-2-yl]formamido}-3-carboxypropanoyl]pyrrolidine-2-carboxylic acid

C19H28N4O9 (456.18561980000004)


   

Glu Pro Pro Asp

(2S)-2-{[(2S)-1-{[(2S)-1-[(2S)-2-amino-4-carboxybutanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}butanedioic acid

C19H28N4O9 (456.18561980000004)


   

Glu Thr Ala His

(4S)-4-amino-4-{[(1S,2R)-1-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Glu Thr His Ala

(4S)-4-amino-4-{[(1S,2R)-1-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Phe Cys Ser Thr

(2S,3R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Phe Cys Thr Ser

(2S)-2-[(2S,3R)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Phe Ser Cys Thr

(2S,3R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Phe Ser Thr Cys

(2R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxypropanamido]-3-hydroxybutanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Phe Thr Cys Ser

(2S)-2-[(2R)-2-[(2S,3R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Phe Thr Ser Cys

(2R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxybutanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Gly Asp Glu His

(4S)-4-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-4-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

Gly Asp His Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C17H24N6O9 (456.1604694)


   

Gly Glu Asp His

(4S)-4-(2-aminoacetamido)-4-{[(1S)-2-carboxy-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

Gly Glu His Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

Gly His Asp Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]pentanedioic acid

C17H24N6O9 (456.1604694)


   

Gly His Glu Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

Gly Met Ser Tyr

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Gly Met Tyr Ser

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Gly Ser Met Tyr

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Gly Ser Tyr Met

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanoic acid

C19H28N4O7S (456.1678618)


   

Gly Tyr Met Ser

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Gly Tyr Ser Met

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-4-(methylsulfanyl)butanoic acid

C19H28N4O7S (456.1678618)


   

His Ala Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]propanamido]-3-carboxypropanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

His Ala Glu Thr

(4S)-4-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]propanamido]-4-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

His Ala Thr Glu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]propanamido]-3-hydroxybutanamido]pentanedioic acid

C18H28N6O8 (456.1968528)


   

His Cys Pro Thr

(2S,3R)-2-{[(2S)-1-[(2R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-hydroxybutanoic acid

C18H28N6O6S (456.17909480000003)


   

His Cys Thr Pro

(2S)-1-[(2S,3R)-2-[(2R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanamido]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

C18H28N6O6S (456.17909480000003)


   

His Asp Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]propanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

His Asp Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C17H24N6O9 (456.1604694)


   

His Asp Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C17H24N6O9 (456.1604694)


   

His Asp Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]acetamido}pentanedioic acid

C17H24N6O9 (456.1604694)


   

His Asp Ser Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-3-hydroxypropanamido]-3-methylbutanoic acid

C18H28N6O8 (456.1968528)


   

His Asp Val Ser

(3S)-3-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

His Glu Ala Thr

(4S)-4-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-{[(1S)-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

His Glu Asp Gly

(4S)-4-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-{[(1S)-2-carboxy-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}butanoic acid

C17H24N6O9 (456.1604694)


   

His Glu Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanamido]acetamido}butanedioic acid

C17H24N6O9 (456.1604694)


   

His Glu Thr Ala

(4S)-4-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-{[(1S,2R)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

His Gly Asp Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-carboxypropanamido]pentanedioic acid

C17H24N6O9 (456.1604694)


   

His Gly Glu Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-4-carboxybutanamido]butanedioic acid

C17H24N6O9 (456.1604694)


   

His Pro Cys Thr

(2S,3R)-2-[(2R)-2-{[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-hydroxybutanoic acid

C18H28N6O6S (456.17909480000003)


   

His Pro Thr Cys

(2R)-2-[(2S,3R)-2-{[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-hydroxybutanamido]-3-sulfanylpropanoic acid

C18H28N6O6S (456.17909480000003)


   

His Ser Asp Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C18H28N6O8 (456.1968528)


   

His Ser Val Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]-3-methylbutanamido]butanedioic acid

C18H28N6O8 (456.1968528)


   

His Thr Ala Glu

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]propanamido]pentanedioic acid

C18H28N6O8 (456.1968528)


   

His Thr Cys Pro

(2S)-1-[(2R)-2-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C18H28N6O6S (456.17909480000003)


   

His Thr Glu Ala

(4S)-4-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

His Thr Pro Cys

(2R)-2-{[(2S)-1-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C18H28N6O6S (456.17909480000003)


   

His Val Asp Ser

(3S)-3-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

His Val Ser Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanamido]-3-hydroxypropanamido]butanedioic acid

C18H28N6O8 (456.1968528)


   

Met Gly Ser Tyr

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Met Gly Tyr Ser

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Met Ser Gly Tyr

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]acetamido}-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Met Ser Tyr Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]acetic acid

C19H28N4O7S (456.1678618)


   

Met Tyr Gly Ser

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Met Tyr Ser Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]acetic acid

C19H28N4O7S (456.1678618)


   

Pro Cys His Thr

(2S,3R)-3-hydroxy-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]propanamido]butanoic acid

C18H28N6O6S (456.17909480000003)


   

Pro Cys Thr His

(2S)-2-[(2S,3R)-3-hydroxy-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]butanamido]-3-(1H-imidazol-4-yl)propanoic acid

C18H28N6O6S (456.17909480000003)


   

Pro Asp Glu Pro

(2S)-1-[(2S)-4-carboxy-2-[(2S)-3-carboxy-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]butanoyl]pyrrolidine-2-carboxylic acid

C19H28N4O9 (456.18561980000004)


   

Pro Asp Pro Glu

(2S)-2-{[(2S)-1-[(2S)-3-carboxy-2-[(2S)-pyrrolidin-2-ylformamido]propanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C19H28N4O9 (456.18561980000004)


   

Pro Glu Asp Pro

(2S)-1-[(2S)-3-carboxy-2-[(2S)-4-carboxy-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]propanoyl]pyrrolidine-2-carboxylic acid

C19H28N4O9 (456.18561980000004)


   

Pro Glu Pro Asp

(2S)-2-{[(2S)-1-[(2S)-4-carboxy-2-[(2S)-pyrrolidin-2-ylformamido]butanoyl]pyrrolidin-2-yl]formamido}butanedioic acid

C19H28N4O9 (456.18561980000004)


   

Pro His Cys Thr

(2S,3R)-3-hydroxy-2-[(2R)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-3-sulfanylpropanamido]butanoic acid

C18H28N6O6S (456.17909480000003)


   

Pro His Thr Cys

(2R)-2-[(2S,3R)-3-hydroxy-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]butanamido]-3-sulfanylpropanoic acid

C18H28N6O6S (456.17909480000003)


   

Pro Pro Asp Glu

(2S)-2-[(2S)-3-carboxy-2-{[(2S)-1-{[(2S)-pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}propanamido]pentanedioic acid

C19H28N4O9 (456.18561980000004)


   

Pro Pro Glu Asp

(2S)-2-[(2S)-4-carboxy-2-{[(2S)-1-{[(2S)-pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}butanamido]butanedioic acid

C19H28N4O9 (456.18561980000004)


   

Pro Thr Cys His

(2S)-2-[(2R)-2-[(2S,3R)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C18H28N6O6S (456.17909480000003)


   

Pro Thr His Cys

(2R)-2-[(2S)-2-[(2S,3R)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoic acid

C18H28N6O6S (456.17909480000003)


   

Ser Cys Phe Thr

(2S,3R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Ser Cys Thr Phe

(2S)-2-[(2S,3R)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-phenylpropanoic acid

C19H28N4O7S (456.1678618)


   

Ser Asp His Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanoic acid

C18H28N6O8 (456.1968528)


   

Ser Asp Val His

(3S)-3-[(2S)-2-amino-3-hydroxypropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Ser Phe Cys Thr

(2S,3R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Ser Phe Thr Cys

(2R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-phenylpropanamido]-3-hydroxybutanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Ser Gly Met Tyr

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Ser Gly Tyr Met

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanoic acid

C19H28N4O7S (456.1678618)


   

Ser His Asp Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C18H28N6O8 (456.1968528)


   

Ser His Val Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanamido]butanedioic acid

C18H28N6O8 (456.1968528)


   

Ser Met Gly Tyr

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]acetamido}-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Ser Met Tyr Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]acetic acid

C19H28N4O7S (456.1678618)


   

Ser Ser Thr Tyr

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxypropanamido]-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O9 (456.18561980000004)


   

Ser Ser Tyr Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanoic acid

C19H28N4O9 (456.18561980000004)


   

Ser Thr Cys Phe

(2S)-2-[(2R)-2-[(2S,3R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C19H28N4O7S (456.1678618)


   

Ser Thr Phe Cys

(2R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxybutanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Ser Thr Ser Tyr

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxybutanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O9 (456.18561980000004)


   

Ser Thr Tyr Ser

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C19H28N4O9 (456.18561980000004)


   

Ser Val Asp His

(3S)-3-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-methylbutanamido]-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Ser Val His Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-methylbutanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C18H28N6O8 (456.1968528)


   

Ser Tyr Gly Met

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C19H28N4O7S (456.1678618)


   

Ser Tyr Met Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]acetic acid

C19H28N4O7S (456.1678618)


   

Ser Tyr Ser Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-hydroxybutanoic acid

C19H28N4O9 (456.18561980000004)


   

Ser Tyr Thr Ser

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]-3-hydroxypropanoic acid

C19H28N4O9 (456.18561980000004)


   

Thr Ala Cys Tyr

(2S)-2-[(2R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]propanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Thr Ala Glu His

(4S)-4-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]propanamido]-4-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Thr Ala His Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]propanamido]-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C18H28N6O8 (456.1968528)


   

Thr Ala Tyr Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Thr Cys Ala Tyr

(2S)-2-[(2S)-2-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanamido]propanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O7S (456.1678618)


   

Thr Cys Phe Ser

(2S)-2-[(2S)-2-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Thr Cys His Pro

(2S)-1-[(2S)-2-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C18H28N6O6S (456.17909480000003)


   

Thr Cys Pro His

(2S)-2-{[(2S)-1-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanoic acid

C18H28N6O6S (456.17909480000003)


   

Thr Cys Ser Phe

(2S)-2-[(2S)-2-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-phenylpropanoic acid

C19H28N4O7S (456.1678618)


   

Thr Cys Tyr Ala

(2S)-2-[(2S)-2-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]propanoic acid

C19H28N4O7S (456.1678618)


   

Thr Glu Ala His

(4S)-4-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Thr Glu His Ala

(4S)-4-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Thr Phe Cys Ser

(2S)-2-[(2R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Thr Phe Ser Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-phenylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Thr His Ala Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]propanamido]pentanedioic acid

C18H28N6O8 (456.1968528)


   

Thr His Cys Pro

(2S)-1-[(2R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C18H28N6O6S (456.17909480000003)


   

Thr His Glu Ala

(4S)-4-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C18H28N6O8 (456.1968528)


   

Thr His Pro Cys

(2R)-2-{[(2S)-1-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C18H28N6O6S (456.17909480000003)


   

Thr Pro Cys His

(2S)-2-[(2R)-2-{[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C18H28N6O6S (456.17909480000003)


   

Thr Pro His Cys

(2R)-2-[(2S)-2-{[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoic acid

C18H28N6O6S (456.17909480000003)


   

Thr Ser Cys Phe

(2S)-2-[(2R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C19H28N4O7S (456.1678618)


   

Thr Ser Phe Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxypropanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Thr Ser Ser Tyr

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxypropanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C19H28N4O9 (456.18561980000004)


   

Thr Ser Tyr Ser

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C19H28N4O9 (456.18561980000004)


   

Thr Tyr Ala Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]propanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Thr Tyr Cys Ala

(2S)-2-[(2R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]propanoic acid

C19H28N4O7S (456.1678618)


   

Thr Tyr Ser Ser

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-hydroxypropanoic acid

C19H28N4O9 (456.18561980000004)


   

Val Asp His Ser

(3S)-3-[(2S)-2-amino-3-methylbutanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Val Asp Ser His

(3S)-3-[(2S)-2-amino-3-methylbutanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Val His Asp Ser

(3S)-3-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Val His Ser Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]butanedioic acid

C18H28N6O8 (456.1968528)


   

Val Ser Asp His

(3S)-3-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-hydroxypropanamido]-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C18H28N6O8 (456.1968528)


   

Val Ser His Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C18H28N6O8 (456.1968528)


   

Tyr Ala Cys Thr

(2S,3R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]propanamido]-3-sulfanylpropanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Ala Thr Cys

(2R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]propanamido]-3-hydroxybutanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Cys Ala Thr

(2S,3R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]propanamido]-3-hydroxybutanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Cys Thr Ala

(2S)-2-[(2S,3R)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-hydroxybutanamido]propanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Gly Met Ser

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-4-(methylsulfanyl)butanamido]-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Gly Ser Met

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-3-hydroxypropanamido]-4-(methylsulfanyl)butanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Met Gly Ser

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]acetamido}-3-hydroxypropanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Met Ser Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]acetic acid

C19H28N4O7S (456.1678618)


   

Tyr Ser Gly Met

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Ser Met Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]acetic acid

C19H28N4O7S (456.1678618)


   

Tyr Ser Ser Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-hydroxypropanamido]-3-hydroxybutanoic acid

C19H28N4O9 (456.18561980000004)


   

Tyr Ser Thr Ser

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-hydroxybutanamido]-3-hydroxypropanoic acid

C19H28N4O9 (456.18561980000004)


   

Tyr Thr Ala Cys

(2R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]propanamido]-3-sulfanylpropanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Thr Cys Ala

(2S)-2-[(2R)-2-[(2S,3R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]-3-sulfanylpropanamido]propanoic acid

C19H28N4O7S (456.1678618)


   

Tyr Thr Ser Ser

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]-3-hydroxypropanamido]-3-hydroxypropanoic acid

C19H28N4O9 (456.18561980000004)


   

15-keto Fluprostenol

(±)15-oxo-9α,11α-dihydroxy-16,16-(3-(trifluoromethyl)phenoxy)-17,18,19,20-tetranor-prosta-5Z,13E-dien-1-oic acid

C23H27F3O6 (456.17596380000003)


   

Atrovirinone

methyl 2,4-dihydroxy-6-{[2-methoxy-4,5-bis(3-methylbut-2-en-1-yl)-3,6-dioxocyclohexa-1,4-dien-1-yl]oxy}benzoate

C25H28O8 (456.1784088)


   

9a-hydroxy-2,2,6,8,10,12b-hexamethyl-15-methylene-6a,7,8,9a,10,12b,13,13a-octahydro-2H,9H,12H-6,13-epoxy-8,12a-methanofuro[3,4:6,7]oxireno[2,3:3,4]heptaleno[3,2-c]pyran-4,9,12(6H)-trione

9a-hydroxy-2,2,6,8,10,12b-hexamethyl-15-methylene-6a,7,8,9a,10,12b,13,13a-octahydro-2H,9H,12H-6,13-epoxy-8,12a-methanofuro[3,4:6,7]oxireno[2,3:3,4]heptaleno[3,2-c]pyran-4,9,12(6H)-trione

C25H28O8 (456.1784088)


   

4,4-Bis(diethylmethylphosphonate)-2,2-bipyridine

4,4-Bis(diethylmethylphosphonate)-2,2-bipyridine

C20H30N2O6P2 (456.157902)


   

Levocabastine hydrochloride

Levocabastine hydrochloride

C26H30ClFN2O2 (456.1979722)


D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist

   

1H-1-Benzazepine-1-aceticacid,3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2,3,4,5-tetrahydro-2-oxo-(9CI)

1H-1-Benzazepine-1-aceticacid,3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2,3,4,5-tetrahydro-2-oxo-(9CI)

C27H24N2O5 (456.1685134)


   

1-methoxy-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]-1-phenylpropan-2-ol,dihydrochloride

1-methoxy-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]-1-phenylpropan-2-ol,dihydrochloride

C23H34Cl2N2O3 (456.19463540000004)


   

3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]-N-(2-hydroxyethyl)-N-methylpropionamide

3-[ethyl[4-[(5-nitro-2,1-benzisothiazol-3-yl)azo]phenyl]amino]-N-(2-hydroxyethyl)-N-methylpropionamide

C21H24N6O4S (456.1579664)


   

n,n-methanetetraylbis[4-[(4-isocyanatophenyl)methyl]-benzenamin

n,n-methanetetraylbis[4-[(4-isocyanatophenyl)methyl]-benzenamin

C29H20N4O2 (456.158618)


   

7-Bromo-9,9-dihexylfluoren-2-yl-boronic acid

7-Bromo-9,9-dihexylfluoren-2-yl-boronic acid

C25H34BBrO2 (456.1835074)


   
   

5-(8-AMINO-7-CHLORO-2,3-DIHYDROBENZO[B][1,4]DIOXIN-5-YL)-3-(1-PHENETHYLPIPERIDIN-4-YL)-1,3,4-OXADIAZOL-2(3H)-ONE

5-(8-AMINO-7-CHLORO-2,3-DIHYDROBENZO[B][1,4]DIOXIN-5-YL)-3-(1-PHENETHYLPIPERIDIN-4-YL)-1,3,4-OXADIAZOL-2(3H)-ONE

C23H25ClN4O4 (456.156424)


   

1-[3-(1,3-benzodioxol-5-yloxy)propyl]-4-phenylpiperazine

1-[3-(1,3-benzodioxol-5-yloxy)propyl]-4-phenylpiperazine

C24H28N2O7 (456.1896418)


   
   
   

AZD 3988

AZD 3988

C23H22F2N4O4 (456.16090360000004)


AZD3988 is an orally active diacylglycerol acyl transferase-1 (DGAT-1) inhibitor. AZD3988 has excellent DGAT-1 (human) potency with an IC50 value of 0. 6 nM. AZD3988 can be used for the research of metabolic diseases such as diabetes, obesity[1].

   

3-Isomangostin hydrate formate

3-Isomangostin hydrate formate

C25H28O8 (456.1784088)


   
   

1,7-Bis(3,4,5-trimethoxyphenyl)hepta-1,6-diene-3,5-dione

1,7-Bis(3,4,5-trimethoxyphenyl)hepta-1,6-diene-3,5-dione

C25H28O8 (456.1784088)


   

S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] hexanethioate

S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] hexanethioate

C17H33N2O8PS (456.16951480000006)


   
   

2,15-Dioxapentacyclo[22.2.2.13,7.110,14.016,21]triaconta-1(26),3(30),4,6,10(29),11,13,16(21),17,19,24,27-dodecaene-4,5,8,17-tetrol

2,15-Dioxapentacyclo[22.2.2.13,7.110,14.016,21]triaconta-1(26),3(30),4,6,10(29),11,13,16(21),17,19,24,27-dodecaene-4,5,8,17-tetrol

C28H24O6 (456.1572804)


   

3-Hydroxy-9-methoxy-6-oxo-8-pentanoyl-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid

3-Hydroxy-9-methoxy-6-oxo-8-pentanoyl-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid

C25H28O8 (456.1784088)


   
   

(1S,4aS,11aR,12aS)-3-carbamoyl-10-(dimethylamino)-1-(dimethylazaniumyl)-4a,7-dihydroxy-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracene-2,5-diolate

(1S,4aS,11aR,12aS)-3-carbamoyl-10-(dimethylamino)-1-(dimethylazaniumyl)-4a,7-dihydroxy-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracene-2,5-diolate

C23H26N3O7- (456.17706660000005)


   

2-[[4-(3-amino-1-oxo-5,6,6a,7-tetrahydro-2H-imidazo[1,5-f]pteridin-10-ium-8-yl)benzoyl]amino]pentanedioic acid

2-[[4-(3-amino-1-oxo-5,6,6a,7-tetrahydro-2H-imidazo[1,5-f]pteridin-10-ium-8-yl)benzoyl]amino]pentanedioic acid

C20H22N7O6+ (456.1631492)


   

S-hexanoyl-4-phosphopantetheine

S-hexanoyl-4-phosphopantetheine

C17H33N2O8PS (456.16951480000006)


An S-acyl-4-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4-phosphate with the carboxy group of hexanoic acid.

   

Hexaphenylene

Hexaphenylene

C36H24 (456.1877904)


   

(2E)-2-(4-methylbenzylidene)-6-[4-(2-pyridyl)piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one

(2E)-2-(4-methylbenzylidene)-6-[4-(2-pyridyl)piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one

C26H24N4O2S (456.1619884)


   

6-methyl-3-[[[1-(phenylmethyl)-5-tetrazolyl]methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one

6-methyl-3-[[[1-(phenylmethyl)-5-tetrazolyl]methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one

C25H24N6OS (456.1732214)


   

3-(3-Chlorophenyl)-1-[(1-methyl-3-indolyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea

3-(3-Chlorophenyl)-1-[(1-methyl-3-indolyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea

C24H29ClN4OS (456.17504940000003)


   

N-[1,4-dimethyl-2,3-dioxo-7-(1-piperidinyl)-6-quinoxalinyl]-4-ethylbenzenesulfonamide

N-[1,4-dimethyl-2,3-dioxo-7-(1-piperidinyl)-6-quinoxalinyl]-4-ethylbenzenesulfonamide

C23H28N4O4S (456.18311680000005)


   

(6R,7R,8S)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-(4-((E)-styryl)phenyl)-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7R,8S)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-(4-((E)-styryl)phenyl)-1,4-diazabicyclo[4.2.0]octan-2-one

C28H25FN2O3 (456.1849112)


   

alpha-L-rhamnosyl-(1->2)-alpha-L-rhamnosyl-(1->2)-alpha-L-rhamnose

alpha-L-rhamnosyl-(1->2)-alpha-L-rhamnosyl-(1->2)-alpha-L-rhamnose

C18H32O13 (456.1842822)


   
   
   
   

Ethyl 2-[5-benzyloxy-4-(trifluoromethyl)biphenyl-3-yl]pentanoate

Ethyl 2-[5-benzyloxy-4-(trifluoromethyl)biphenyl-3-yl]pentanoate

C27H27F3O3 (456.1912188)


   

alpha-D-rhamnopyranosyl-(1->2)-alpha-D-rhamnopyranosyl-(1->3)-alpha-D-rhamnopyranose

alpha-D-rhamnopyranosyl-(1->2)-alpha-D-rhamnopyranosyl-(1->3)-alpha-D-rhamnopyranose

C18H32O13 (456.1842822)


   

alpha-D-rhamnopyranosyl-(1->3)-alpha-D-rhamnopyranosyl-(1->2)-alpha-D-rhamnopyranose

alpha-D-rhamnopyranosyl-(1->3)-alpha-D-rhamnopyranosyl-(1->2)-alpha-D-rhamnopyranose

C18H32O13 (456.1842822)


   

alpha-D-abequosyl-(1->3)-alpha-D-mannosyl-(1->4)-alpha-L-rhamnose

alpha-D-abequosyl-(1->3)-alpha-D-mannosyl-(1->4)-alpha-L-rhamnose

C18H32O13 (456.1842822)


   

alpha-D-rhamnopyranosyl-(1->2)-[alpha-D-rhamnopyranosyl-(1->3)]-alpha-D-rhamnopyranose

alpha-D-rhamnopyranosyl-(1->2)-[alpha-D-rhamnopyranosyl-(1->3)]-alpha-D-rhamnopyranose

C18H32O13 (456.1842822)


   

2-[(2R,4aS,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

2-[(2R,4aS,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

C24H25FN2O6 (456.16965619999996)


   

[(3aR,4S,9bR)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aR,4S,9bR)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

C28H25FN2O3 (456.1849112)


   

N-[2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

N-[2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

C21H32N2O7S (456.1930122)


   

N-[2-[(2R,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

N-[2-[(2R,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

C21H32N2O7S (456.1930122)


   

2-[(2S,4aS,12aS)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

2-[(2S,4aS,12aS)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

C24H25FN2O6 (456.16965619999996)


   

N-[2-[(2R,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

N-[2-[(2R,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

C21H32N2O7S (456.1930122)


   

N-[2-[(2S,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]oxan-2-yl]ethyl]oxane-4-carboxamide

N-[2-[(2S,5S,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]oxan-2-yl]ethyl]oxane-4-carboxamide

C21H32N2O7S (456.1930122)


   

2-[(2S,4aS,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

2-[(2S,4aS,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

C24H25FN2O6 (456.16965619999996)


   

N-[2-[(2R,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

N-[2-[(2R,5S,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

C21H32N2O7S (456.1930122)


   

2-[(2S,4aR,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

2-[(2S,4aR,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

C24H25FN2O6 (456.16965619999996)


   

[(3aR,4R,9bR)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aR,4R,9bR)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

C28H25FN2O3 (456.1849112)


   

[(3aR,4R,9bR)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aR,4R,9bR)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

C23H25FN4O3S (456.16313119999995)


   

[(3aS,4S,9bS)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aS,4S,9bS)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

C23H25FN4O3S (456.16313119999995)


   

[(3aR,4S,9bR)-4-(hydroxymethyl)-8-[2-(4-methoxyphenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone

[(3aR,4S,9bR)-4-(hydroxymethyl)-8-[2-(4-methoxyphenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone

C28H25FN2O3 (456.1849112)


   

1-[(1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]-2-methoxyethanone

1-[(1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]-2-methoxyethanone

C23H28N4O4S (456.18311680000005)


   

N-[2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

N-[2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

C21H32N2O7S (456.1930122)


   

N-[2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

N-[2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

C21H32N2O7S (456.1930122)


   

N-[2-[(2S,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

N-[2-[(2S,5R,6R)-6-(hydroxymethyl)-5-[(2-methoxyphenyl)sulfonylamino]-2-oxanyl]ethyl]-4-oxanecarboxamide

C21H32N2O7S (456.1930122)


   

2-[(2R,4aR,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

2-[(2R,4aR,12aR)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

C24H25FN2O6 (456.16965619999996)


   

2-[(2R,4aR,12aS)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

2-[(2R,4aR,12aS)-8-[[(2-fluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester

C24H25FN2O6 (456.16965619999996)


   

[(3aS,4R,9bS)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aS,4R,9bS)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

C28H25FN2O3 (456.1849112)


   

[(3aS,4S,9bS)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aS,4S,9bS)-1-(1,3-benzodioxol-5-ylmethyl)-8-[2-(4-fluorophenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

C28H25FN2O3 (456.1849112)


   

[(3aR,4S,9bR)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aR,4S,9bR)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

C23H25FN4O3S (456.16313119999995)


   

[(3aS,4R,9bS)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aS,4R,9bS)-8-(2-fluorophenyl)-5-methyl-1-[(4-methyl-4H-imidazol-2-yl)sulfonyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

C23H25FN4O3S (456.16313119999995)


   

(3aR,4R,9bS)-8-(4-cyanophenyl)-N-(3-fluorophenyl)-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide

(3aR,4R,9bS)-8-(4-cyanophenyl)-N-(3-fluorophenyl)-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide

C27H25FN4O2 (456.19614419999994)


   

[(3aS,4S,9bS)-4-(hydroxymethyl)-8-[2-(4-methoxyphenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone

[(3aS,4S,9bS)-4-(hydroxymethyl)-8-[2-(4-methoxyphenyl)ethynyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone

C28H25FN2O3 (456.1849112)


   

1-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]-2-methoxyethanone

1-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]-2-methoxyethanone

C23H28N4O4S (456.18311680000005)


   

(6R,7R,8S)-7-[4-(1-cyclopentenyl)phenyl]-4-(3-fluorophenyl)sulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7R,8S)-7-[4-(1-cyclopentenyl)phenyl]-4-(3-fluorophenyl)sulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

C24H25FN2O4S (456.1518982)


   

(6R,7R,8R)-7-[4-(1-cyclopentenyl)phenyl]-4-(3-fluorophenyl)sulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7R,8R)-7-[4-(1-cyclopentenyl)phenyl]-4-(3-fluorophenyl)sulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

C24H25FN2O4S (456.1518982)


   

(6S,7R,8R)-7-[4-(1-cyclopentenyl)phenyl]-4-(3-fluorophenyl)sulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

(6S,7R,8R)-7-[4-(1-cyclopentenyl)phenyl]-4-(3-fluorophenyl)sulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

C24H25FN2O4S (456.1518982)


   

(6R,7R,8R)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-[4-[(E)-2-phenylethenyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7R,8R)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-[4-[(E)-2-phenylethenyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H25FN2O3 (456.1849112)


   

(6S,7S,8R)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-[4-[(E)-2-phenylethenyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6S,7S,8R)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-[4-[(E)-2-phenylethenyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H25FN2O3 (456.1849112)


   

(6S,7S,8S)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-[4-[(E)-2-phenylethenyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6S,7S,8S)-4-(3-fluorobenzoyl)-8-(hydroxymethyl)-7-[4-[(E)-2-phenylethenyl]phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H25FN2O3 (456.1849112)


   
   
   
   

2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl] ester O3,O5-diethyl ester

2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl] ester O3,O5-diethyl ester

C24H28N2O7 (456.1896418)


   

3,4,5-trihydroxy-6-[(E)-5-oxo-1,7-diphenylhept-1-en-3-yl]oxyoxane-2-carboxylic acid

3,4,5-trihydroxy-6-[(E)-5-oxo-1,7-diphenylhept-1-en-3-yl]oxyoxane-2-carboxylic acid

C25H28O8 (456.1784088)


   

6-[2,3-dihydroxy-3-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-7-methoxychromen-2-one

6-[2,3-dihydroxy-3-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-7-methoxychromen-2-one

C21H28O11 (456.16315380000003)


   

Delavirdine

Delavirdine

C22H28N6O3S (456.19434980000005)


J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AG - Non-nucleoside reverse transcriptase inhibitors C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97453 - Non-nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent

   

(6R)-5,10-Methenyltetrahydrofolic acid

(6R)-5,10-Methenyltetrahydrofolic acid

C20H22N7O6 (456.1631492)


The 5,10-methenyl derivative of tetrahydrofolic acid arising from enzymatic cyclisation of 5-formyltetrahydrofolic acid.

   

minocycline(1-)

minocycline(1-)

C23H26N3O7 (456.17706660000005)


An organic anion that is the conjugate base of minocycline, obtained by deprotonation of the two enolic hydroxy groups and protonation of the non-aromatic tertiary amino group.

   
   
   
   

P2X3 antagonist 34

P2X3 antagonist 34

C24H26F2N4O3 (456.19728699999996)


P2X3 antagonist 34 is a potent, selective and orally active P2X3 homotrimeric receptor antagonist with IC50s of 25?nM, 92?nM and 126?nM for human P2X3, rat P2X3 and guinea pig P2X3 receptors, respectively. P2X3 antagonist 34 is less active against human, rat and guinea pig P2X2/3 heterotrimeric receptors. P2X3 antagonist 34 has strong anti-tussive effect[1].

   

13,15-dimethyl 15-hydroxy-20-methoxy-17-oxa-3,13-diazaheptacyclo[12.6.2.0¹,¹⁶.0²,⁶.0³,¹⁸.0⁶,¹⁴.0⁷,¹²]docosa-7,9,11-triene-13,15-dicarboxylate

13,15-dimethyl 15-hydroxy-20-methoxy-17-oxa-3,13-diazaheptacyclo[12.6.2.0¹,¹⁶.0²,⁶.0³,¹⁸.0⁶,¹⁴.0⁷,¹²]docosa-7,9,11-triene-13,15-dicarboxylate

C24H28N2O7 (456.1896418)


   

2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,8,17-tetrol

2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,8,17-tetrol

C28H24O6 (456.1572804)


   

14-hydroxy-2,6,6,13,16,19-hexamethyl-7,15,17,20-tetraoxaspiro[heptacyclo[11.8.1.0¹,¹⁸.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁶.0¹⁴,¹⁸]docosane-22,2'-oxirane]-4,9-diene-8,21-dione

14-hydroxy-2,6,6,13,16,19-hexamethyl-7,15,17,20-tetraoxaspiro[heptacyclo[11.8.1.0¹,¹⁸.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁶.0¹⁴,¹⁸]docosane-22,2'-oxirane]-4,9-diene-8,21-dione

C25H28O8 (456.1784088)


   

4-benzyl-1-[1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-6-oxopyridine-3-carboximidic acid

4-benzyl-1-[1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-6-oxopyridine-3-carboximidic acid

C27H24N2O5 (456.1685134)


   

2,18-dimethyl 17,18-dihydroxy-4-methoxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

2,18-dimethyl 17,18-dihydroxy-4-methoxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

C24H28N2O7 (456.1896418)


   

(1'r,2's,3r,9's,12'r,13'r)-12'-hydroxy-2,2,2',6',9',13'-hexamethyl-16'-methylidene-10',14'-dioxaspiro[pyran-3,5'-tetracyclo[7.6.1.0¹,¹².0²,⁷]hexadecan]-6'-ene-6,8',11',15'-tetrone

(1'r,2's,3r,9's,12'r,13'r)-12'-hydroxy-2,2,2',6',9',13'-hexamethyl-16'-methylidene-10',14'-dioxaspiro[pyran-3,5'-tetracyclo[7.6.1.0¹,¹².0²,⁷]hexadecan]-6'-ene-6,8',11',15'-tetrone

C25H28O8 (456.1784088)


   

(3s,6s)-3-({4-[(2s)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl}methyl)-1,4-dimethyl-3,6-bis(methylsulfanyl)piperazine-2,5-dione

(3s,6s)-3-({4-[(2s)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl}methyl)-1,4-dimethyl-3,6-bis(methylsulfanyl)piperazine-2,5-dione

C21H32N2O5S2 (456.1752542)


   

(7r,8s,8as)-8-(acetyloxy)-7-methyl-6-oxo-3-[(1e)-prop-1-en-1-yl]-8,8a-dihydro-1h-isochromen-7-yl 2,4-dimethoxy-6-methylbenzoate

(7r,8s,8as)-8-(acetyloxy)-7-methyl-6-oxo-3-[(1e)-prop-1-en-1-yl]-8,8a-dihydro-1h-isochromen-7-yl 2,4-dimethoxy-6-methylbenzoate

C25H28O8 (456.1784088)


   

{2-[4-(acetyloxy)-3-methoxyphenyl]-5-[3-(acetyloxy)propyl]-2,3-dihydro-1-benzofuran-3-yl}methyl acetate

{2-[4-(acetyloxy)-3-methoxyphenyl]-5-[3-(acetyloxy)propyl]-2,3-dihydro-1-benzofuran-3-yl}methyl acetate

C25H28O8 (456.1784088)


   

3-(4-amino-5-hydroxy-6-methyloxan-2-yl)-3,13,23-triazahexacyclo[14.7.0.0²,¹⁰.0⁴,⁹.0¹¹,¹⁵.0¹⁷,²²]tricosa-1(16),2(10),4(9),5,7,11(15),12,17(22),18,20-decaene-7,12-diol

3-(4-amino-5-hydroxy-6-methyloxan-2-yl)-3,13,23-triazahexacyclo[14.7.0.0²,¹⁰.0⁴,⁹.0¹¹,¹⁵.0¹⁷,²²]tricosa-1(16),2(10),4(9),5,7,11(15),12,17(22),18,20-decaene-7,12-diol

C26H24N4O4 (456.1797464)


   

(1r,2s,4s,7s,9r,10r,14r)-7-(furan-3-yl)-9-methyl-5,11,15-trioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadecan-2-yl (2z)-2-methylbut-2-enoate

(1r,2s,4s,7s,9r,10r,14r)-7-(furan-3-yl)-9-methyl-5,11,15-trioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadecan-2-yl (2z)-2-methylbut-2-enoate

C25H28O8 (456.1784088)


   

8-hydroxy-2,2',2',9,13-pentamethyl-6,16-dimethylidene-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-6',11,15-trione

8-hydroxy-2,2',2',9,13-pentamethyl-6,16-dimethylidene-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-6',11,15-trione

C25H28O8 (456.1784088)


   

2,18-dimethyl (1s,9r,16r,17r,18r,21r)-17,18-dihydroxy-4-methoxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

2,18-dimethyl (1s,9r,16r,17r,18r,21r)-17,18-dihydroxy-4-methoxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

C24H28N2O7 (456.1896418)


   

(1s,3ar,4s,9ar)-4-[4-(acetyloxy)-3-methoxyphenyl]-1,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

(1s,3ar,4s,9ar)-4-[4-(acetyloxy)-3-methoxyphenyl]-1,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

C25H28O8 (456.1784088)


   

15,16-epoxy-1-oxo-2,13(16),14-clerodatriene-17,12:18,19-diolide; (ent-8βh,12βh)-form,2,3-dihydro,6α-angeloyloxy

NA

C25H28O8 (456.1784088)


{"Ingredient_id": "HBIN001568","Ingredient_name": "15,16-epoxy-1-oxo-2,13(16),14-clerodatriene-17,12:18,19-diolide; (ent-8\u03b2h,12\u03b2h)-form,2,3-dihydro,6\u03b1-angeloyloxy","Alias": "NA","Ingredient_formula": "C25H28O8","Ingredient_Smile": "NA","Ingredient_weight": "456.48","OB_score": "NA","CAS_id": "96888-53-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9307","PubChem_id": "NA","DrugBank_id": "NA"}

   

2',6'-bis(p-hydroxybenzyl)-3,3'-dihydroxy-5-methoxybibenzyl

NA

C29H28O5 (456.1936638)


{"Ingredient_id": "HBIN004864","Ingredient_name": "2',6'-bis(p-hydroxybenzyl)-3,3'-dihydroxy-5-methoxybibenzyl","Alias": "NA","Ingredient_formula": "C29H28O5","Ingredient_Smile": "COC1=CC(=CC(=C1)O)CCC2=C(C=CC(=C2CC3=CC=C(C=C3)O)O)CC4=CC=C(C=C4)O","Ingredient_weight": "456.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2456","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "67233527","DrugBank_id": "NA"}

   

3′, 3′-dihydroxy- 5-methoxybibenzyl

NA

C29H28O5 (456.1936638)


{"Ingredient_id": "HBIN007175","Ingredient_name": "3\u2032, 3\u2032-dihydroxy- 5-methoxybibenzyl","Alias": "NA","Ingredient_formula": "C29H28O5","Ingredient_Smile": "COC1=CC(=CC(=C1)O)CCC2=C(C=CC(=C2CC3=CC=C(C=C3)O)O)CC4=CC=C(C=C4)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41958","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,17,18-tetrol

2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,17,18-tetrol

C28H24O6 (456.1572804)


   

(6ar)-8-(4-{[(1s)-1,3-dicarboxypropyl]-c-hydroxycarbonimidoyl}phenyl)-1-hydroxy-3-imino-4h,5h,6h,6ah,7h-8λ⁵-imidazo[1,5-f]pteridin-8-ylium

(6ar)-8-(4-{[(1s)-1,3-dicarboxypropyl]-c-hydroxycarbonimidoyl}phenyl)-1-hydroxy-3-imino-4h,5h,6h,6ah,7h-8λ⁵-imidazo[1,5-f]pteridin-8-ylium

[C20H22N7O6]+ (456.1631492)


   

6-benzyl-1-[1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-4-oxopyridine-3-carboximidic acid

6-benzyl-1-[1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-4-oxopyridine-3-carboximidic acid

C27H24N2O5 (456.1685134)


   

(2s,4r,6s,12s,14r,15s,17s,20s)-15-hydroxy-2,7,7,14,17,20-hexamethyl-23-methylidene-5,8,16,18,21-pentaoxaoctacyclo[12.8.1.0¹,¹⁹.0²,¹².0⁴,⁶.0⁶,¹¹.0¹²,¹⁷.0¹⁵,¹⁹]tricos-10-ene-9,22-dione

(2s,4r,6s,12s,14r,15s,17s,20s)-15-hydroxy-2,7,7,14,17,20-hexamethyl-23-methylidene-5,8,16,18,21-pentaoxaoctacyclo[12.8.1.0¹,¹⁹.0²,¹².0⁴,⁶.0⁶,¹¹.0¹²,¹⁷.0¹⁵,¹⁹]tricos-10-ene-9,22-dione

C25H28O8 (456.1784088)


   

2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-(6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl)-2,3-dihydro-1-benzopyran-4-one

2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-(6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl)-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

8,8,22,22-tetramethyl-7,13,21,27-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²⁶.0²⁰,²⁵]octacosa-3(12),4,6(11),9,17(26),18,20(25),23-octaene-14,28-dione

8,8,22,22-tetramethyl-7,13,21,27-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²⁶.0²⁰,²⁵]octacosa-3(12),4,6(11),9,17(26),18,20(25),23-octaene-14,28-dione

C28H24O6 (456.1572804)


   

(1s,2r,5r,7r,8r,9s,13r)-8-hydroxy-2,2',2',9,13-pentamethyl-6,16-dimethylidene-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-6',11,15-trione

(1s,2r,5r,7r,8r,9s,13r)-8-hydroxy-2,2',2',9,13-pentamethyl-6,16-dimethylidene-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-6',11,15-trione

C25H28O8 (456.1784088)


   

(2r,3r)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(2e,6r)-6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl]-2,3-dihydro-1-benzopyran-4-one

(2r,3r)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(2e,6r)-6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl]-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

3-[2-(4-hydroxy-3-{4-[2-(3-methoxyphenyl)ethyl]phenoxy}phenyl)ethyl]benzene-1,2-diol

3-[2-(4-hydroxy-3-{4-[2-(3-methoxyphenyl)ethyl]phenoxy}phenyl)ethyl]benzene-1,2-diol

C29H28O5 (456.1936638)


   

(2s,3r,4s,5s,6r)-2-[(6,7-dimethyl-1-benzofuran-5-yl)oxy]-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol

(2s,3r,4s,5s,6r)-2-[(6,7-dimethyl-1-benzofuran-5-yl)oxy]-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol

C21H28O11 (456.16315380000003)


   

(2s)-5,7-dihydroxy-2-[(3s,4s)-3,4,7-trihydroxy-2,2-dimethyl-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-6-yl]-2,3-dihydro-1-benzopyran-4-one

(2s)-5,7-dihydroxy-2-[(3s,4s)-3,4,7-trihydroxy-2,2-dimethyl-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-6-yl]-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

(3r,4r,6r)-4-amino-6-{12-hydroxy-3,13,23-triazahexacyclo[14.7.0.0²,¹⁰.0⁴,⁹.0¹¹,¹⁵.0¹⁷,²²]tricosa-1(16),2(10),4(9),5,7,11(15),12,17(22),18,20-decaen-3-yl}-2-methyloxane-2,3-diol

(3r,4r,6r)-4-amino-6-{12-hydroxy-3,13,23-triazahexacyclo[14.7.0.0²,¹⁰.0⁴,⁹.0¹¹,¹⁵.0¹⁷,²²]tricosa-1(16),2(10),4(9),5,7,11(15),12,17(22),18,20-decaen-3-yl}-2-methyloxane-2,3-diol

C26H24N4O4 (456.1797464)


   

2,16-dioxapentacyclo[23.2.2.1³,⁷.0¹⁰,¹⁵.0¹⁷,²²]triaconta-1(27),3,5,7(30),10,12,14,17,19,21,25,28-dodecaene-4,5,18,19-tetrol

2,16-dioxapentacyclo[23.2.2.1³,⁷.0¹⁰,¹⁵.0¹⁷,²²]triaconta-1(27),3,5,7(30),10,12,14,17,19,21,25,28-dodecaene-4,5,18,19-tetrol

C28H24O6 (456.1572804)


   

13,15-dimethyl (1s,2r,6r,14s,15r,16r,18s,20s)-15-hydroxy-20-methoxy-17-oxa-3,13-diazaheptacyclo[12.6.2.0¹,¹⁶.0²,⁶.0³,¹⁸.0⁶,¹⁴.0⁷,¹²]docosa-7,9,11-triene-13,15-dicarboxylate

13,15-dimethyl (1s,2r,6r,14s,15r,16r,18s,20s)-15-hydroxy-20-methoxy-17-oxa-3,13-diazaheptacyclo[12.6.2.0¹,¹⁶.0²,⁶.0³,¹⁸.0⁶,¹⁴.0⁷,¹²]docosa-7,9,11-triene-13,15-dicarboxylate

C24H28N2O7 (456.1896418)


   

(1r,3r,5s,9r,18s)-18-(methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadeca-2(10),12(19),14-trien-3-yl 2-methylpropanoate

(1r,3r,5s,9r,18s)-18-(methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadeca-2(10),12(19),14-trien-3-yl 2-methylpropanoate

C25H28O8 (456.1784088)


   

5-[2-(3-hydroxyphenyl)ethyl]-2,4-bis[(4-hydroxyphenyl)methyl]-3-methoxyphenol

5-[2-(3-hydroxyphenyl)ethyl]-2,4-bis[(4-hydroxyphenyl)methyl]-3-methoxyphenol

C29H28O5 (456.1936638)


   

methyl 2-[(3as,4r,5s,6s)-4-hydroxy-3-(hydroxymethyl)-6-{[2-(4-hydroxyphenyl)acetyl]oxy}-6,8-dimethyl-1-oxo-3a,4,5,7-tetrahydroazulen-5-yl]prop-2-enoate

methyl 2-[(3as,4r,5s,6s)-4-hydroxy-3-(hydroxymethyl)-6-{[2-(4-hydroxyphenyl)acetyl]oxy}-6,8-dimethyl-1-oxo-3a,4,5,7-tetrahydroazulen-5-yl]prop-2-enoate

C25H28O8 (456.1784088)


   

2-[2-(4-{2-hydroxy-5-[2-(3-methoxyphenyl)ethyl]phenoxy}phenyl)ethyl]benzene-1,4-diol

2-[2-(4-{2-hydroxy-5-[2-(3-methoxyphenyl)ethyl]phenoxy}phenyl)ethyl]benzene-1,4-diol

C29H28O5 (456.1936638)


   

5-[2-(3-hydroxyphenyl)ethyl]-3-{4-[2-(3-hydroxyphenyl)ethyl]phenoxy}-2-methoxyphenol

5-[2-(3-hydroxyphenyl)ethyl]-3-{4-[2-(3-hydroxyphenyl)ethyl]phenoxy}-2-methoxyphenol

C29H28O5 (456.1936638)


   

23-hydroxy-17,18-dimethoxy-4-methyl-7,10-dioxa-4,14-diazaheptacyclo[10.8.3.2¹¹,¹⁴.0¹,¹³.0⁶,⁸.0⁶,²³.0¹⁵,²⁰]pentacosa-15(20),16,18-triene-21,24-dione

23-hydroxy-17,18-dimethoxy-4-methyl-7,10-dioxa-4,14-diazaheptacyclo[10.8.3.2¹¹,¹⁴.0¹,¹³.0⁶,⁸.0⁶,²³.0¹⁵,²⁰]pentacosa-15(20),16,18-triene-21,24-dione

C24H28N2O7 (456.1896418)


   

(1s,2r,5r,7r,8r,9s,12r,13r)-8-hydroxy-2,2',2',9,13-pentamethyl-6,16-dimethylidene-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-6',11,15-trione

(1s,2r,5r,7r,8r,9s,12r,13r)-8-hydroxy-2,2',2',9,13-pentamethyl-6,16-dimethylidene-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-6',11,15-trione

C25H28O8 (456.1784088)


   

8-(3,5-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethenyl]bicyclo[2.2.2]oct-5-en-2-one

8-(3,5-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethenyl]bicyclo[2.2.2]oct-5-en-2-one

C28H24O6 (456.1572804)


   

(2r,3r,4s,5s,6r)-2-[(6-methyl-1-benzofuran-3-yl)methoxy]-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-[(6-methyl-1-benzofuran-3-yl)methoxy]-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol

C21H28O11 (456.16315380000003)


   

2-[(6-methyl-1-benzofuran-3-yl)methoxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triol

2-[(6-methyl-1-benzofuran-3-yl)methoxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triol

C21H28O11 (456.16315380000003)


   

(1s,12r,13r,14r)-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl propanoate

(1s,12r,13r,14r)-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl propanoate

C25H28O8 (456.1784088)


   

methyl 6,14-dihydroxy-10-oxo-12-pentanoyl-4-pentyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylate

methyl 6,14-dihydroxy-10-oxo-12-pentanoyl-4-pentyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylate

C25H28O8 (456.1784088)


   

(1s,6r,8r,11r,12r,13s,23s)-23-hydroxy-17,18-dimethoxy-4-methyl-7,10-dioxa-4,14-diazaheptacyclo[10.8.3.2¹¹,¹⁴.0¹,¹³.0⁶,⁸.0⁶,²³.0¹⁵,²⁰]pentacosa-15(20),16,18-triene-21,24-dione

(1s,6r,8r,11r,12r,13s,23s)-23-hydroxy-17,18-dimethoxy-4-methyl-7,10-dioxa-4,14-diazaheptacyclo[10.8.3.2¹¹,¹⁴.0¹,¹³.0⁶,⁸.0⁶,²³.0¹⁵,²⁰]pentacosa-15(20),16,18-triene-21,24-dione

C24H28N2O7 (456.1896418)


   

4-[4-(acetyloxy)-3-methoxyphenyl]-1,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

4-[4-(acetyloxy)-3-methoxyphenyl]-1,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

C25H28O8 (456.1784088)


   

2-[(3s,4s)-3,4-dihydroxy-2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

2-[(3s,4s)-3,4-dihydroxy-2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl (2e)-3-phenylprop-2-enoate

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl (2e)-3-phenylprop-2-enoate

C21H28O11 (456.16315380000003)


   

10-{[2-(4-hydroxyphenyl)ethyl]amino}-5,11,12-trimethoxy-16-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,9,11,13,15-octaen-8-one

10-{[2-(4-hydroxyphenyl)ethyl]amino}-5,11,12-trimethoxy-16-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,9,11,13,15-octaen-8-one

C27H24N2O5 (456.1685134)


   

2-{3,5-dimethoxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-5,6,7-trimethoxychromen-4-one

2-{3,5-dimethoxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-5,6,7-trimethoxychromen-4-one

C25H28O8 (456.1784088)


   

2,21-dimethyl (1s,12r,19r,21s,24s)-21-hydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.1¹²,¹⁵.0¹,¹².0³,¹¹.0⁴,⁸.0¹⁹,²⁴]tetracosa-3(11),4(8),9-triene-2,21-dicarboxylate

2,21-dimethyl (1s,12r,19r,21s,24s)-21-hydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.1¹²,¹⁵.0¹,¹².0³,¹¹.0⁴,⁸.0¹⁹,²⁴]tetracosa-3(11),4(8),9-triene-2,21-dicarboxylate

C24H28N2O7 (456.1896418)


   

7-(furan-3-yl)-9-methyl-5,11,15-trioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadecan-2-yl 2-methylbut-2-enoate

7-(furan-3-yl)-9-methyl-5,11,15-trioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadecan-2-yl 2-methylbut-2-enoate

C25H28O8 (456.1784088)


   

(1r,12r,13r,14r)-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl propanoate

(1r,12r,13r,14r)-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl propanoate

C25H28O8 (456.1784088)


   

(2s)-5,7-dihydroxy-2-[3,4,8-trihydroxy-2,2-dimethyl-7-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-6-yl]-2,3-dihydro-1-benzopyran-4-one

(2s)-5,7-dihydroxy-2-[3,4,8-trihydroxy-2,2-dimethyl-7-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-6-yl]-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

8-(3,5-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxyphenyl)-6-[(1e)-2-(4-hydroxyphenyl)ethenyl]bicyclo[2.2.2]oct-5-en-2-one

8-(3,5-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxyphenyl)-6-[(1e)-2-(4-hydroxyphenyl)ethenyl]bicyclo[2.2.2]oct-5-en-2-one

C28H24O6 (456.1572804)


   

5-ethenyl-1-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl 2-methylbut-2-enoate

5-ethenyl-1-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl 2-methylbut-2-enoate

C21H28O11 (456.16315380000003)


   

[(2s,3r)-2-[4-(acetyloxy)-3-methoxyphenyl]-5-[3-(acetyloxy)propyl]-2,3-dihydro-1-benzofuran-3-yl]methyl acetate

[(2s,3r)-2-[4-(acetyloxy)-3-methoxyphenyl]-5-[3-(acetyloxy)propyl]-2,3-dihydro-1-benzofuran-3-yl]methyl acetate

C25H28O8 (456.1784088)


   

(1s,2s,6s,7s,8s)-7-hydroxy-2,6-dimethyl-14-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4,11-dioxatetracyclo[6.3.3.0¹,⁸.0²,⁶]tetradec-13-ene-5,10-dione

(1s,2s,6s,7s,8s)-7-hydroxy-2,6-dimethyl-14-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4,11-dioxatetracyclo[6.3.3.0¹,⁸.0²,⁶]tetradec-13-ene-5,10-dione

C21H28O11 (456.16315380000003)


   

(1s,4r,7s,8r)-7-(3,5-dihydroxyphenyl)-1-hydroxy-8-(4-hydroxyphenyl)-5-[(1e)-2-(4-hydroxyphenyl)ethenyl]bicyclo[2.2.2]oct-5-en-2-one

(1s,4r,7s,8r)-7-(3,5-dihydroxyphenyl)-1-hydroxy-8-(4-hydroxyphenyl)-5-[(1e)-2-(4-hydroxyphenyl)ethenyl]bicyclo[2.2.2]oct-5-en-2-one

C28H24O6 (456.1572804)


   

18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl propanoate

18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl propanoate

C25H28O8 (456.1784088)


   

(1r,2s,4r,13s,15r,16s)-4-hydroxy-2,6,6,13,16-pentamethyl-19-methylidene-8,14,18-trioxo-7,17-dioxapentacyclo[11.5.1.0¹,¹⁵.0²,¹¹.0⁵,¹⁰]nonadeca-5(10),11-dien-15-yl acetate

(1r,2s,4r,13s,15r,16s)-4-hydroxy-2,6,6,13,16-pentamethyl-19-methylidene-8,14,18-trioxo-7,17-dioxapentacyclo[11.5.1.0¹,¹⁵.0²,¹¹.0⁵,¹⁰]nonadeca-5(10),11-dien-15-yl acetate

C25H28O8 (456.1784088)


   

4-methoxy-6-[3-(4-methoxy-6-oxopyran-2-yl)-2,4-diphenylcyclobutyl]pyran-2-one

4-methoxy-6-[3-(4-methoxy-6-oxopyran-2-yl)-2,4-diphenylcyclobutyl]pyran-2-one

C28H24O6 (456.1572804)


   

(1s,2r,5r,6r,7s,9s)-7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-5-yl furan-3-carboxylate

(1s,2r,5r,6r,7s,9s)-7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-5-yl furan-3-carboxylate

C25H28O8 (456.1784088)


   

(23s)-2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,17,23-tetrol

(23s)-2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,17,23-tetrol

C28H24O6 (456.1572804)


   

(2s)-2-[(3s,4s)-3,4-dihydroxy-2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

(2s)-2-[(3s,4s)-3,4-dihydroxy-2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

6-hydroxy-14-methoxy-10-oxo-12-pentanoyl-4-pentyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid

6-hydroxy-14-methoxy-10-oxo-12-pentanoyl-4-pentyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid

C25H28O8 (456.1784088)


   

(1s,2r,5r,6r,7s,9r)-7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-5-yl furan-3-carboxylate

(1s,2r,5r,6r,7s,9r)-7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-5-yl furan-3-carboxylate

C25H28O8 (456.1784088)


   

15-hydroxy-2,7,7,14,17,20-hexamethyl-23-methylidene-5,8,16,18,21-pentaoxaoctacyclo[12.8.1.0¹,¹⁹.0²,¹².0⁴,⁶.0⁶,¹¹.0¹²,¹⁷.0¹⁵,¹⁹]tricos-10-ene-9,22-dione

15-hydroxy-2,7,7,14,17,20-hexamethyl-23-methylidene-5,8,16,18,21-pentaoxaoctacyclo[12.8.1.0¹,¹⁹.0²,¹².0⁴,⁶.0⁶,¹¹.0¹²,¹⁷.0¹⁵,¹⁹]tricos-10-ene-9,22-dione

C25H28O8 (456.1784088)


   

(3s,6r)-3-({4-[(2s)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl}methyl)-1,4-dimethyl-3,6-bis(methylsulfanyl)piperazine-2,5-dione

(3s,6r)-3-({4-[(2s)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl}methyl)-1,4-dimethyl-3,6-bis(methylsulfanyl)piperazine-2,5-dione

C21H32N2O5S2 (456.1752542)


   

7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-5-yl furan-3-carboxylate

7-(furan-3-carbonyloxy)-2,6,10,10-tetramethyl-4-oxo-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-5-yl furan-3-carboxylate

C25H28O8 (456.1784088)


   

8-(acetyloxy)-7-methyl-6-oxo-3-(prop-1-en-1-yl)-8,8a-dihydro-1h-isochromen-7-yl 2,4-dimethoxy-6-methylbenzoate

8-(acetyloxy)-7-methyl-6-oxo-3-(prop-1-en-1-yl)-8,8a-dihydro-1h-isochromen-7-yl 2,4-dimethoxy-6-methylbenzoate

C25H28O8 (456.1784088)


   

5-[(2s,3s)-4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol

5-[(2s,3s)-4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol

C28H24O6 (456.1572804)


   

2-[(6,7-dimethyl-1-benzofuran-5-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triol

2-[(6,7-dimethyl-1-benzofuran-5-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triol

C21H28O11 (456.16315380000003)


   

(1r,6s,7s,8s)-5-methoxy-8-(4-methoxy-6-oxopyran-2-yl)-7-phenyl-1-[(1e)-2-phenylethenyl]-2-oxabicyclo[4.2.0]oct-4-en-3-one

(1r,6s,7s,8s)-5-methoxy-8-(4-methoxy-6-oxopyran-2-yl)-7-phenyl-1-[(1e)-2-phenylethenyl]-2-oxabicyclo[4.2.0]oct-4-en-3-one

C28H24O6 (456.1572804)


   

4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-diphenylcyclobutyl]pyran-2-one

4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-diphenylcyclobutyl]pyran-2-one

C28H24O6 (456.1572804)


   

(2s,11s,13r,14s,16s,19s)-14-hydroxy-2,6,6,13,16,19-hexamethyl-7,15,17,20-tetraoxaspiro[heptacyclo[11.8.1.0¹,¹⁸.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁶.0¹⁴,¹⁸]docosane-22,2'-oxirane]-4,9-diene-8,21-dione

(2s,11s,13r,14s,16s,19s)-14-hydroxy-2,6,6,13,16,19-hexamethyl-7,15,17,20-tetraoxaspiro[heptacyclo[11.8.1.0¹,¹⁸.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁶.0¹⁴,¹⁸]docosane-22,2'-oxirane]-4,9-diene-8,21-dione

C25H28O8 (456.1784088)


   

14,14,23,23-tetramethyl-5,13,18,24-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁴,⁹.0¹⁹,²⁸.0²⁰,²⁵]octacosa-3,7,9,11,19(28),20(25),21,26-octaene-6,17-dione

14,14,23,23-tetramethyl-5,13,18,24-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁴,⁹.0¹⁹,²⁸.0²⁰,²⁵]octacosa-3,7,9,11,19(28),20(25),21,26-octaene-6,17-dione

C28H24O6 (456.1572804)


   

(1s,2s,15s,16r)-8,8,22,22-tetramethyl-7,13,21,27-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²⁶.0²⁰,²⁵]octacosa-3,5,9,11,17(26),18,20(25),23-octaene-14,28-dione

(1s,2s,15s,16r)-8,8,22,22-tetramethyl-7,13,21,27-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²⁶.0²⁰,²⁵]octacosa-3,5,9,11,17(26),18,20(25),23-octaene-14,28-dione

C28H24O6 (456.1572804)


   

(1s,3ar,4s,9as)-4-[4-(acetyloxy)-3-methoxyphenyl]-1,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

(1s,3ar,4s,9as)-4-[4-(acetyloxy)-3-methoxyphenyl]-1,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

C25H28O8 (456.1784088)


   

2,21-dimethyl (12r,21s,24s)-21-hydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.1¹²,¹⁵.0¹,¹².0³,¹¹.0⁴,⁸.0¹⁹,²⁴]tetracosa-3(11),4(8),9-triene-2,21-dicarboxylate

2,21-dimethyl (12r,21s,24s)-21-hydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.1¹²,¹⁵.0¹,¹².0³,¹¹.0⁴,⁸.0¹⁹,²⁴]tetracosa-3(11),4(8),9-triene-2,21-dicarboxylate

C24H28N2O7 (456.1896418)


   

6-hydroxy-14-methoxy-10-oxo-12-(2-oxopentyl)-4-pentyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene-5-carboxylic acid

6-hydroxy-14-methoxy-10-oxo-12-(2-oxopentyl)-4-pentyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene-5-carboxylic acid

C25H28O8 (456.1784088)


   

5-[4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol

5-[4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol

C28H24O6 (456.1572804)


   

5-methoxy-8-(4-methoxy-6-oxopyran-2-yl)-7-phenyl-1-(2-phenylethenyl)-2-oxabicyclo[4.2.0]oct-4-en-3-one

5-methoxy-8-(4-methoxy-6-oxopyran-2-yl)-7-phenyl-1-(2-phenylethenyl)-2-oxabicyclo[4.2.0]oct-4-en-3-one

C28H24O6 (456.1572804)


   

2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,17,23-tetrol

2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,17,23-tetrol

C28H24O6 (456.1572804)


   

(3z)-3-[(acetyloxy)methyl]-4-(2h-1,3-benzodioxol-5-yl)-2-[(3,4-dimethoxyphenyl)methyl]but-3-en-1-yl acetate

(3z)-3-[(acetyloxy)methyl]-4-(2h-1,3-benzodioxol-5-yl)-2-[(3,4-dimethoxyphenyl)methyl]but-3-en-1-yl acetate

C25H28O8 (456.1784088)


   

(2r)-5-hydroxy-7-[(1r,2r)-2-hydroxy-2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]-1-phenylethyl]-2-phenyl-2,3-dihydro-1-benzopyran-4-one

(2r)-5-hydroxy-7-[(1r,2r)-2-hydroxy-2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]-1-phenylethyl]-2-phenyl-2,3-dihydro-1-benzopyran-4-one

C28H24O6 (456.1572804)


   

4-hydroxy-2,6,6,13,16-pentamethyl-19-methylidene-8,14,18-trioxo-7,17-dioxapentacyclo[11.5.1.0¹,¹⁵.0²,¹¹.0⁵,¹⁰]nonadeca-5(10),11-dien-15-yl acetate

4-hydroxy-2,6,6,13,16-pentamethyl-19-methylidene-8,14,18-trioxo-7,17-dioxapentacyclo[11.5.1.0¹,¹⁵.0²,¹¹.0⁵,¹⁰]nonadeca-5(10),11-dien-15-yl acetate

C25H28O8 (456.1784088)


   

2-{3,4-dihydroxy-2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]-3,4-dihydro-1-benzopyran-6-yl}-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

2-{3,4-dihydroxy-2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]-3,4-dihydro-1-benzopyran-6-yl}-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

3-[2-(3-hydroxyphenyl)ethyl]-2,6-bis[(4-hydroxyphenyl)methyl]-5-methoxyphenol

3-[2-(3-hydroxyphenyl)ethyl]-2,6-bis[(4-hydroxyphenyl)methyl]-5-methoxyphenol

C29H28O5 (456.1936638)


   

(3s,4as,5r,6s)-5-ethenyl-1-oxo-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl (2e)-2-methylbut-2-enoate

(3s,4as,5r,6s)-5-ethenyl-1-oxo-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl (2e)-2-methylbut-2-enoate

C21H28O11 (456.16315380000003)


   

5,13,17,19-tetrahydroxy-22,22-dimethyl-7-pentylpentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1,3(12),4(9),5,7,10,13,16,18,20-decaen-15-one

5,13,17,19-tetrahydroxy-22,22-dimethyl-7-pentylpentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1,3(12),4(9),5,7,10,13,16,18,20-decaen-15-one

C29H28O5 (456.1936638)


   

6-benzyl-1-[(1s)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-4-oxopyridine-3-carboximidic acid

6-benzyl-1-[(1s)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-4-oxopyridine-3-carboximidic acid

C27H24N2O5 (456.1685134)


   

5,7-dihydroxy-2-[3,4,7-trihydroxy-2,2-dimethyl-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-6-yl]-2,3-dihydro-1-benzopyran-4-one

5,7-dihydroxy-2-[3,4,7-trihydroxy-2,2-dimethyl-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-6-yl]-2,3-dihydro-1-benzopyran-4-one

C25H28O8 (456.1784088)


   

4-[(8-acetyl-5,7-dihydroxy-2,2-dimethylchromen-6-yl)methyl]-3,5-dihydroxy-6,6-dimethyl-2-propanoylcyclohexa-2,4-dien-1-one

4-[(8-acetyl-5,7-dihydroxy-2,2-dimethylchromen-6-yl)methyl]-3,5-dihydroxy-6,6-dimethyl-2-propanoylcyclohexa-2,4-dien-1-one

C25H28O8 (456.1784088)


   

4-benzyl-1-[(1s)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-6-oxopyridine-3-carboximidic acid

4-benzyl-1-[(1s)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-6-oxopyridine-3-carboximidic acid

C27H24N2O5 (456.1685134)


   

2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-[5-hydroxy-5-methyl-2-(prop-1-en-2-yl)hexyl]chromen-4-one

2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-[5-hydroxy-5-methyl-2-(prop-1-en-2-yl)hexyl]chromen-4-one

C25H28O8 (456.1784088)


   

(8r)-2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,8,17-tetrol

(8r)-2,15-dioxapentacyclo[22.2.2.1³,⁷.1¹⁰,¹⁴.0¹⁶,²¹]triaconta-1(26),3,5,7(30),10(29),11,13,16,18,20,24,27-dodecaene-4,5,8,17-tetrol

C28H24O6 (456.1572804)


   

3-[2-(3-hydroxyphenyl)ethyl]-2,4-bis[(4-hydroxyphenyl)methyl]-5-methoxyphenol

3-[2-(3-hydroxyphenyl)ethyl]-2,4-bis[(4-hydroxyphenyl)methyl]-5-methoxyphenol

C29H28O5 (456.1936638)


   

3-[(2r,4r,5r,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]-3,13,23-triazahexacyclo[14.7.0.0²,¹⁰.0⁴,⁹.0¹¹,¹⁵.0¹⁷,²²]tricosa-1(16),2(10),4(9),5,7,11(15),12,17(22),18,20-decaene-7,12-diol

3-[(2r,4r,5r,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]-3,13,23-triazahexacyclo[14.7.0.0²,¹⁰.0⁴,⁹.0¹¹,¹⁵.0¹⁷,²²]tricosa-1(16),2(10),4(9),5,7,11(15),12,17(22),18,20-decaene-7,12-diol

C26H24N4O4 (456.1797464)


   

18-(methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadeca-2(10),12(19),14-trien-3-yl 2-methylpropanoate

18-(methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadeca-2(10),12(19),14-trien-3-yl 2-methylpropanoate

C25H28O8 (456.1784088)