Exact Mass: 424.17985980000003

Exact Mass Matches: 424.17985980000003

Found 500 metabolites which its exact mass value is equals to given mass value 424.17985980000003, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Clindamycin

(2S,4R)-N-{2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfanyl)oxan-2-yl]propyl}-1-methyl-4-propylpyrrolidine-2-carboxamide

C18H33ClN2O5S (424.17985980000003)


Clindamycin is a semisynthetic lincosamide antibiotic that has largely replaced lincomycin due to an improved side effect profile. Clindamycin inhibits bacterial protein synthesis by binding to bacterial 50S ribosomal subunits. It may be bacteriostatic or bactericidal depending on the organism and drug concentration. Clindamycin, also known as cleocin or 7-CDL, belongs to the class of organic compounds known as proline and derivatives. Proline and derivatives are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Clindamycin is a drug. Clindamycin is a semisynthetic lincosamide antibiotic that has largely replaced lincomycin due to an improved side effect profile. Clindamycin is a very strong basic compound (based on its pKa). In humans, clindamycin is involved in clindamycin action pathway. Orally and parenterally administered clindamycin has been associated with severe colitis (pseudomembranous colitis) which may result in patient death. Use of the topical formulation of clindamycin results in absorption of the antibiotic from the skin surface. Clindamycin is a potentially toxic compound. Rapidly absorbed after oral administration with peak serum concentrations observed after about 45 minutes. Oral; topical; parenteral (intramuscular, intravenous). Systemic/vaginal clindamycin inhibits protein synthesis of bacteria by binding to the 50S ribosomal subunits of the bacteria. Clindamycin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=18323-44-9 (retrieved 2024-06-28) (CAS RN: 18323-44-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

N,N'-diacetylchitobiose

N-[(3R,4R,5S,6R)-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

C16H28N2O11 (424.16930179999997)


N,N-diacetylchitobiose, also known as (GlcNAc)2, is classified as a member of the Acylaminosugars. Acylaminosugars are organic compounds containing a sugar linked to a chain through N-acyl group. N,N-diacetylchitobiose is considered to be soluble (in water) and acidic. N,N-diacetylchitobiose may be a unique E.coli metabolite N,N'-Diacetylchitobiose is a dimer of β(1,4) linked N-acetyl-D glucosamine. N,N'-Diacetylchitobiose is the hydrolysate of chitin and can be used as alternative carbon source by?E. coli[1].

   
   

2,2-Dimethyl-3-(4-methoxyphenyl)-4-ethyl-7-hydroxy-2H-1-benzopyran-8-methanol diacetate

2,2-Dimethyl-3-(4-methoxyphenyl)-4-ethyl-7-hydroxy-2H-1-benzopyran-8-methanol diacetate

C25H28O6 (424.1885788)


   

Bisphenol A ethoxylate diacrylate

Bisphenol A bis(2-hydroxyethyl ether) diacrylate

C25H28O6 (424.1885788)


   

Marini

Sophoraflavanone G

C25H28O6 (424.1885788)


Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].

   

Trimethobenzamide hydrochloride

Trimethobenzamide hydrochloride

C21H29ClN2O5 (424.17648940000004)


D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents C78272 - Agent Affecting Nervous System > C267 - Antiemetic Agent D005765 - Gastrointestinal Agents > D000932 - Antiemetics D002491 - Central Nervous System Agents Trimethobenzamide hydrochloride is a blocker of the D2 receptor. Trimethobenzamide is an antiemetic used to prevent nausea and vomiting.

   

beta-Mangostin

1,6-Dihydroxy-3,7-dimethoxy-2,8-bis(3-methyl-2-buten-1-yl)-9H-xanthen-9-one

C25H28O6 (424.1885788)


Beta-Mangostin is a member of xanthones. beta-Mangostin is a natural product found in Garcinia oliveri, Garcinia cowa, and other organisms with data available. From Garcinia mangostana (mangosteen). beta-Mangostin is found in fruits and purple mangosteen. beta-Mangostin is found in fruits. beta-Mangostin is from Garcinia mangostana (mangosteen). beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4]. beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4].

   

Taraxinic acid glucosyl ester

3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl 10-methyl-3-methylidene-2-oxo-2H,3H,3ah,4H,5H,8H,9H,11ah-cyclodeca[b]furan-6-carboxylic acid

C21H28O9 (424.17332380000005)


Constituent of Taraxacum officinale (dandelion). Taraxinic acid glucosyl ester is found in many foods, some of which are coffee and coffee products, dandelion, tea, and alcoholic beverages. Taraxinic acid glucosyl ester is found in alcoholic beverages. Taraxinic acid glucosyl ester is a constituent of Taraxacum officinale (dandelion).

   

(S)-3',4',5,7-Tetrahydroxy-5',8-diprenylflavanone

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

C25H28O6 (424.1885788)


(S)-3,4,5,7-Tetrahydroxy-5,8-diprenylflavanone is found in herbs and spices. (S)-3,4,5,7-Tetrahydroxy-5,8-diprenylflavanone is isolated from Glycyrrhiza uralensis (Chinese licorice). Isolated from Glycyrrhiza uralensis (Chinese licorice). Gancaonin E is found in herbs and spices.

   

Dulxanthone C

1,5-dihydroxy-3,6-dimethoxy-4,8-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one

C25H28O6 (424.1885788)


Dulxanthone C is found in fruits. Dulxanthone C is a constituent of the stem bark of Garcinia dulcis (mundu)

   

Kuwanon E

2-{5-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxyphenyl}-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one

C25H28O6 (424.1885788)


Kuwanon E is found in fruits. Kuwanon E is a constituent of Morus alba (white mulberry)

   

Glisoflavanone

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

C25H28O6 (424.1885788)


(±)-Glisoflavanone is found in herbs and spices. (±)-Glisoflavanone is a constituent of Glycyrrhiza uralensis (Chinese licorice). Constituent of Glycyrrhiza uralensis (Chinese licorice). (±)-Glisoflavanone is found in herbs and spices.

   

1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone

1,7-dihydroxy-3,6-dimethoxy-2,8-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one

C25H28O6 (424.1885788)


1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone is found in fruits. 1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone is a constituent of Garcinia mangostana (mangosteen). Constituent of Garcinia mangostana (mangosteen). 1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone is found in fruits.

   

(±)-2',4',5,7-Tetrahydroxy-3',8-diprenylisoflavanone

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

C25H28O6 (424.1885788)


(±)-2,4,5,7-Tetrahydroxy-3,8-diprenylisoflavanone is found in herbs and spices. (±)-2,4,5,7-Tetrahydroxy-3,8-diprenylisoflavanone is isolated from Phaseolus lunatus (butter bean) seedlings under stress and from Glycyrrhiza glabra (licorice Isolated from Phaseolus lunatus (butter bean) seedlings under stress and from Glycyrrhiza glabra (licorice). (±)-2,4,5,7-Tetrahydroxy-3,8-diprenylisoflavanone is found in tea, herbs and spices, and pulses.

   

3-Methyl-2-butenyl-(-)-piperitol

5-[4-(3-methoxy-4-{[(1Z)-3-methylbut-1-en-1-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2H-1,3-benzodioxole

C25H28O6 (424.1885788)


3-Methyl-2-butenyl-(-)-piperitol is found in herbs and spices. 3-Methyl-2-butenyl-(-)-piperitol is a constituent of Zanthoxylum piperitum (Japanese pepper tree). Constituent of Zanthoxylum piperitum (Japanese pepper tree). 3-Methyl-2-butenyl-(-)-piperitol is found in herbs and spices.

   

8-Acetylneosolaniol

[4,11-Bis(acetyloxy)-10-hydroxy-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-2-yl]methyl acetic acid

C21H28O9 (424.17332380000005)


   

Calix[4]arene

pentacyclo[19.3.1.1^{3,7}.1^{9,13}.1^{15,19}]octacosa-1(25),3,5,7(28),9(27),10,12,15(26),16,18,21,23-dodecaene-25,26,27,28-tetrol

C28H24O4 (424.1674504)


   

Methanone, ((2R,5R)-5-(((5-fluoro-2-pyridinyl)oxy)methyl)-2-methyl-1-piperidinyl)(5-fluoro-2-(2-pyrimidinyl)phenyl)-

Methanone, ((2R,5R)-5-(((5-fluoro-2-pyridinyl)oxy)methyl)-2-methyl-1-piperidinyl)(5-fluoro-2-(2-pyrimidinyl)phenyl)-

C23H22F2N4O2 (424.1710736)


   

Forsmann antigen

N-(4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)acetamide

C16H28N2O11 (424.16930179999997)


   

Galnac-1-4-glcnac

N-(4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,5,6-trihydroxy-1-oxohexan-2-yl)acetamide

C16H28N2O11 (424.16930179999997)


   

Lacdinac

N-(5-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl)acetamide

C16H28N2O11 (424.16930179999997)


N,N'-Diacetylchitobiose is a dimer of β(1,4) linked N-acetyl-D glucosamine. N,N'-Diacetylchitobiose is the hydrolysate of chitin and can be used as alternative carbon source by?E. coli[1].

   

Sophoraflavanone G

2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-3,4-dihydro-2H-1-benzopyran-4-one

C25H28O6 (424.1885788)


Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].

   

SPIRADOLINE

2-(3,4-dichlorophenyl)-N-methyl-N-[7-(pyrrolidin-1-yl)-1-oxaspiro[4.5]decan-8-yl]acetamide

C22H30Cl2N2O2 (424.16842199999996)


   

Crepidiaside B

(3S,3aS,9aS,9bS)-3,6-dimethyl-9-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-2H,3H,3aH,4H,5H,7H,9aH,9bH-azuleno[4,5-b]furan-2,7-dione

C21H28O9 (424.17332380000005)


Crepidiaside b is a member of the class of compounds known as O-glycosyl compounds. O-glycosyl compounds are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond. Crepidiaside b is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Crepidiaside b can be found in chicory and endive, which makes crepidiaside b a potential biomarker for the consumption of these food products.

   

Cowaxanthone B

1,3-Dihydroxy-6,7-dimethoxy-2,8-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one

C25H28O6 (424.1885788)


Cowaxanthone B is a natural product found in Garcinia cowa and Cratoxylum arborescens with data available.

   

Kuwanon E

(S) -2- [ 5- [ (E) -3,7-Dimethyl-2,6-octadienyl ] -2,4-dihydroxyphenyl ] -2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one

C25H28O6 (424.1885788)


Kuwanon E is a member of flavanones. 4H-1-Benzopyran-4-one, 2-(5-((2E)-3,7-dimethyl-2,6-octadienyl)-2,4-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-, (2S)- is a natural product found in Morus lhou, Morus mongolica, and other organisms with data available.

   

Sophoraflavanone_G

4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(2,4-dihydroxyphenyl)-8-(5-methyl-2-(1-methylethenyl)-4-hexenyl)-, (S-(R*,S*))-

C25H28O6 (424.1885788)


Sophoraflavanone G is a tetrahydroxyflavanone having a structure of naringenin bearing an additional hydroxyl substituent at position 2 as well as a (2R)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl (lavandulyl) substituent at position 8. It has a role as an antioxidant, an antimalarial, an antimicrobial agent and a plant metabolite. It is a tetrahydroxyflavanone, a member of 4-hydroxyflavanones and a (2S)-flavan-4-one. It is functionally related to a (S)-naringenin. Sophoraflavanone G is a natural product found in Sophora stenophylla, Sophora moorcroftiana, and other organisms with data available. A tetrahydroxyflavanone having a structure of naringenin bearing an additional hydroxyl substituent at position 2 as well as a (2R)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl (lavandulyl) substituent at position 8. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].

   

FLLL-31

(1E,6E)-1,7-BIS(3,4-DIMETHOXYPHENYL)-4,4-DIMETHYLHEPTA-1,6-DIENE-3,5-DIONE

C25H28O6 (424.1885788)


Tetramethylcurcumin (FLLL31), derived from curcumin, specifically suppresses the phosphorylation of STAT3 by binding selectively to Janus kinase 2 and the STAT3 Src homology-2 domain. Tetramethylcurcumin exhibits anti-inflammatory and anti-cancer effects[1][2].

   
   
   

[3aR-(3aR*,5E,9Z,11aR*)]- 2,3,3a,4,7,8,11,11a-Octahydro-6-methyl-3-methylene-2-oxo-, beta-D-glucopyranosyl ester cyclodeca[b]furan-10-carboxylic acid

[3aR-(3aR*,5E,9Z,11aR*)]- 2,3,3a,4,7,8,11,11a-Octahydro-6-methyl-3-methylene-2-oxo-, beta-D-glucopyranosyl ester cyclodeca[b]furan-10-carboxylic acid

C21H28O9 (424.17332380000005)


   

SOPHORAFLAVANONE L

SOPHORAFLAVANONE L

C25H28O6 (424.1885788)


A trihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 2 and 4, a prenyl group at position 8 and a prenyloxy group at position 7. Isolated from the roots of Sophora flavescens, it exhibits cytotoxicity towards KB epidermoid carcinoma cell line.

   

Orientanol E

3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methyl-2-buten-1-yl)-2,3-dihydro-4H-chromen-4-one

C25H28O6 (424.1885788)


   
   
   
   

arugosin A (lactol form)

arugosin A (lactol form)

C25H28O6 (424.1885788)


A dibenzooxepine that is dibenzo[b,e]oxepin-11(6H)-one which is substituted by hydroxy groups at positions 1, 6, and 10, a 3,3-dimethylallyl group at position 2, a 3,3-dimethylallyloxy group at position 7, and a methyl group at position 8.

   

Euchrestaflavanone B

Euchrestaflavanone B

C25H28O6 (424.1885788)


   

arugosin B

arugosin B

C25H28O6 (424.1885788)


A dibenzooxepine that is dibenzo[b,e]oxepin-11(6H)-one substituted by hydroxy groups at positions 1, 6 and 10, a methyl group at position 8, a prenyl group at position 4 and a prenyloxy group at position 7. Isolated from Aspergillus, it exhibits antibacterial activity.

   

dihydroptychantol A

dihydroptychantol A

C28H24O4 (424.1674504)


   
   
   
   
   
   
   
   

3,5,4-Trihydroxy-7-geranyloxyflavanone

3,5,4-Trihydroxy-7-geranyloxyflavanone

C25H28O6 (424.1885788)


   
   
   

Lupiniol A1

5,7,4-Trihydroxy-6-C- (2-hydroxy-3-methyl-3-butenyl) -8-C-prenylflavanone

C25H28O6 (424.1885788)


   

Orientanol D

3,7,2,4-Tetrahydroxy-6,8-diprenylisoflavanone

C25H28O6 (424.1885788)


   

dalversinol A

5,7,2,4-Tetrahydroxy-8-prenyl-3-(1,1-dimethyl-2-propenyl)isoflavanone

C25H28O6 (424.1885788)


   

24-Dihydroxy-5-(1,1-dimethylallyl)-6-C-prenylpinocembrin

24-Dihydroxy-5-(1,1-dimethylallyl)-6-C-prenylpinocembrin

C25H28O6 (424.1885788)


   

Tetrapterol G

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

C25H28O6 (424.1885788)


   

Lonchocarpol D1

5,4-Dihydroxy-8-prenyl-5"- (2-hydroxyisopropyl) [ 2",3":7,6 ] dihydrofuranoflavanone

C25H28O6 (424.1885788)


   
   

1,5-Dihydroxy-3,6-dimethoxy-2,7-diprenylxanthone

1,5-Dihydroxy-3,6-dimethoxy-2,7-diprenylxanthone

C25H28O6 (424.1885788)


   

3,5,7,4-Tetrahydroxy-6,8-diprenylflavanone

3,5,7,4-Tetrahydroxy-6,8-diprenylflavanone

C25H28O6 (424.1885788)


   
   
   
   
   
   

Lespedezaflavanone C

(2R,3R)-Lespedezaflavanone C

C25H28O6 (424.1885788)


   

11-O-Demethyl marchantin I

11-O-Demethyl marchantin I

C28H24O4 (424.1674504)


   

5,7,3,4-Tetrahydroxy-6,5-di-C-prenylflavanone

5,7,3,4-Tetrahydroxy-6,5-di-C-prenylflavanone

C25H28O6 (424.1885788)


   
   

Variecoxanthone C

Variecoxanthone C

C25H28O6 (424.1885788)


A member of the class of xanthones that is 9H-xanthen-9-one substituted by a (3,3-dimethyoxiran-2-yl)methyl group at position 5, a hydroxy group at position 8, a hydroxymethyl group at position 1, a methyl group at position 3 and a prenyloxy group at position 2. It has been isolated from Aspergillus.

   

Lespedezol D5

(6aR,11aR)-3,8,5-Trihydroxy-6-methyl-6-(4-methyl-3-prenyl)-4,5-dihydropyrano[2,3:9,10]pterocarpan

C25H28O6 (424.1885788)


   
   
   

Bonanniol A

(2R,3R) -6- [ (E) -3,7-Dimethyl-2,6-octadienyl ] -2,3-dihydro-3,5,7-trihydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one

C25H28O6 (424.1885788)


   
   
   
   
   
   

Lonchocarpol C1

5,4-Dihydroxy-6-prenyl-5"- (2-hydroxyisopropyl) [ 2",3":7,8 ] dihydrofuranoflavanone

C25H28O6 (424.1885788)


   
   
   
   

Abyssinoflavanone VII

Abyssinoflavanone VII

C25H28O6 (424.1885788)


   

Kenusanone A

5,7,2,4-Tetrahydroxy-5-[(2E)-3,7-dimethyl-2,6-octadienyl]isoflavanone

C25H28O6 (424.1885788)


   

Sophoraflavanone C

Sophoraflavanone C

C25H28O6 (424.1885788)


   

8-O-Isobutyryl-9-O-acetylanthemolide B

8-O-Isobutyryl-9-O-acetylanthemolide B

C21H28O9 (424.17332380000005)


   

Arugosin C

1,12a-Dihydro-6,8-dihydroxy-1-(1-hydroxy-1-methylethyl)-4-methyl-9-(3-methylbut-2-enyl[1]benzopyrano[4,5-bc][1]benzoxepin-7(2H)-one

C25H28O6 (424.1885788)


An organic heterotetracyclic compound that is 1,12a-dihydrochromeno[4,5-bc][1]benzoxepin-7(2H)-one substituted by a hydroxy group at position 8, a 2-hydroxypropan-2-yl group at position 1, a methyl group at position 4 and a prenyl group at position 9. Isolated from Aspergillus, it exhibits inhibitory activity against hepatitis C protease.

   

Exiguaflavanone L

Exiguaflavanone L

C25H28O6 (424.1885788)


   

Kenusanone H

5,7,2,4-Tetrahydroxy-8-[(2E)-3,7-dimethyl-2,6-octadienyl]isoflavanone

C25H28O6 (424.1885788)


   
   
   

Flemiflavanone D

2- [ 3- [ (3,3-Dimethyloxiranyl) methyl ] -4-hydroxyphenyl ] -2,3-dihydro-5,7-dihydroxy-6- (3-methyl-2-butenyl) -4H-1-benzopyran-4-one

C25H28O6 (424.1885788)


   
   
   

6,8-Diprenyleriodictyol

(S) -2- (3,4-Dihydroxyphenyl) -2,3-dihydro-5,7-dihydroxy-6,8-bis (3-methyl-2-butenyl) -4H-1-Benzopyran-4-one

C25H28O6 (424.1885788)


   

Angusticornin B

3,5-di- (2-Hydroxy-3-methylbut-3-enyl) -4,2,4-trihydroxychalcone

C25H28O6 (424.1885788)


   
   
   

[4R-(4R*,5S*,6S*,7S*,10R*,11E)]- 3-[(Acetyloxy)methyl]-5,6,7,8,9,10-hexahydro-6,7-dihydroxy-5,6,10-trimethyl-4-(1-oxopropoxy)-7,10-epoxycyclodeca[b]furan-2(4H)-one

[4R-(4R*,5S*,6S*,7S*,10R*,11E)]- 3-[(Acetyloxy)methyl]-5,6,7,8,9,10-hexahydro-6,7-dihydroxy-5,6,10-trimethyl-4-(1-oxopropoxy)-7,10-epoxycyclodeca[b]furan-2(4H)-one

C21H28O9 (424.17332380000005)


   

Leachianone F

5,2,4-Trihydroxy-5-prenyl-6,6-dimethyldihydropyrano[2,3:7,8]flavanone

C25H28O6 (424.1885788)


   
   

Lonchocarpol C2

5-epi-5,4-Dihydroxy-6-prenyl-5-(2-hydroxyisopropyl)[2,3:7,8]dihydrofuranoflavanone

C25H28O6 (424.1885788)


   

Lonchocarpol D2

5-epi-5,4-Dihydroxy-8-prenyl-5-(2-hydroxyisopropyl)[2,3:7,6]dihydrofuranoflavanone

C25H28O6 (424.1885788)


   

dorsmanin J

5,3,4-Trihydroxy-8-prenyl-6",6"-dimethyldihydropyrano [ 2",3":7,6 ] flavanone

C25H28O6 (424.1885788)


   

Dorsmanin E

3,4-Dihydroxy-bis(6,6-dimethyldihydropyrano[2,3:5,6][2,3:7,8])flavanone

C25H28O6 (424.1885788)


   

paratocarpin G

3-Prenyl-5-(2-hydroxyisopropyl)-4-hydroxy-4,5-dihydrofurano[2,3:4,3]-2,4-dihydroxychalcone

C25H28O6 (424.1885788)


   

(2S)-5,7,2,4-Tetrahydroxy-8-prenyl-5-(1,1-dimethylallyl)flavanone

(2S)-5,7,2,4-Tetrahydroxy-8-prenyl-5-(1,1-dimethylallyl)flavanone

C25H28O6 (424.1885788)


   

remangiflavanone B

5,7,2,4-Tetrahydroxy-8-(2-isopropyl-5-methyl-5-hexenyl)flavanone

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 2 and 4 and a lavandulyl group at position 8. Isolated from Physena madagascariensis, it exhibits antibacterial activity.

   

Exiguaflavanone A

(2S) -2,5,6,7-Tetrahydroxy-8- (2-isopropenyl-5-methyl-4-hexenyl) flavanone

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 2 and 6 and a lavandulyl group at position 8. Isolated from Sophora exigua and Artemisia indica, it exhibits antimalarial activity.

   

Abyssinin III

5,7,3,4-Tetrahydroxy-5,6-diprenylflavanone

C25H28O6 (424.1885788)


   

Monotesone B

5,7,3,5-Tetrahydroxy-6,8-diprenylflavanone

C25H28O6 (424.1885788)


   

Sanggenol A

4H-1-Benzopyran-4-one, 2-[3-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-2,4-dihydroxyphenyl]-2,3-dihydro-5,7-dihydroxy-, (2S)-

C25H28O6 (424.1885788)


Sanggenol A is a natural product found in Morus cathayana and Morus alba with data available.

   

diplacone

(2S)-2-[2-[(2E)-3,7-Dimethyl-2,6-octadienyl]-3,4-dihydroxyphenyl]-5,7-dihydroxy-6-(3-methyl-2-butenyl)-2H-1-benzopyran-4(3H)-one

C25H28O6 (424.1885788)


   

3-Dimethylallylkievitone

5,7,2,4-Tetrahydroxy-8,3-diprenylisoflavanone

C25H28O6 (424.1885788)


   
   

norkurarinone

(2S) -5,7-Dihydroxy-2,3-dihydro-2alpha- (2,4-dihydroxyphenyl) -8- [ (R) -5-methyl-2- (1-methylethenyl) -4-hexenyl ] -4H-1-benzopyran-4-one

C25H28O6 (424.1885788)


Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].

   
   
   

DIHYDROMUNDULETONE

DIHYDROMUNDULETONE

C25H28O6 (424.1885788)


Dihydromunduletone (DHM) is a rotenoid derivative and a selective, potent adhesion G protein-coupled receptor (aGPCR) (GPR56 and GPR114/ADGRG5) antagonist with an IC 50 of 20.9 μM for GPR56, but not inhibit GPR110 or class A GPCRs[1].

   
   

Hypochoeroside Ialphaalphabetaalpha

Hypochoeroside Ialphaalphabetaalpha

C21H28O9 (424.17332380000005)


   
   

9-(3-Hydroxy-3-methylglutaroyloxy)-abscisic acid|beta-hydroxy-beta-methylglutarylhydroxyabscisic acid

9-(3-Hydroxy-3-methylglutaroyloxy)-abscisic acid|beta-hydroxy-beta-methylglutarylhydroxyabscisic acid

C21H28O9 (424.17332380000005)


   

15-glucopyranosyloxy-2-oxo-guaia-3,11(13)-dien-1beta,5alpha,6beta,7alpha,10alphaH-12,6-olide

15-glucopyranosyloxy-2-oxo-guaia-3,11(13)-dien-1beta,5alpha,6beta,7alpha,10alphaH-12,6-olide

C21H28O9 (424.17332380000005)


   

2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

NCGC00385984-01!2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


   

(S)-Diplacone|6-geranyl-3,4,5,7-tetrahydroxy-flavanone|6-geranyl-3,4,5,7-tetrahydroxyflavanone|Diplacone|nymphaenol A|nymphaeol-A|nymphaerol A

(S)-Diplacone|6-geranyl-3,4,5,7-tetrahydroxy-flavanone|6-geranyl-3,4,5,7-tetrahydroxyflavanone|Diplacone|nymphaenol A|nymphaeol-A|nymphaerol A

C25H28O6 (424.1885788)


   
   
   
   

1-(2,4-dihydroxyphenyl)-3-[8-hydroxy-2-methyl-2-(4-hydroxy-4-methyl-2-pentenyl)-2h-1-benzopyran-5-yl]-1-propanone

1-(2,4-dihydroxyphenyl)-3-[8-hydroxy-2-methyl-2-(4-hydroxy-4-methyl-2-pentenyl)-2h-1-benzopyran-5-yl]-1-propanone

C25H28O6 (424.1885788)


   

vexibinol

InChI=1\C25H28O6\c1-13(2)5-6-15(14(3)4)9-18-20(28)11-21(29)24-22(30)12-23(31-25(18)24)17-8-7-16(26)10-19(17)27\h5,7-8,10-11,15,23,26-29H,3,6,9,12H2,1-2,4H3\t15?,23-\m0\s

C25H28O6 (424.1885788)


Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].

   

glyenflanin F|Glyinflanin F

glyenflanin F|Glyinflanin F

C25H28O6 (424.1885788)


   
   

8-(3,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)-3,4,7,8-tetrahydropyrano[3,2-g]chromen-6-one

8-(3,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)-3,4,7,8-tetrahydropyrano[3,2-g]chromen-6-one

C25H28O6 (424.1885788)


   
   

Poinsettifolactone

Poinsettifolactone

C25H28O6 (424.1885788)


   

11,13alpha-dihydroixerin Z|11beta,13-dihydroixerin Z

11,13alpha-dihydroixerin Z|11beta,13-dihydroixerin Z

C21H28O9 (424.17332380000005)


   

1-Epicyclolycoserin-6alpha,7alpha-epoxid

1-Epicyclolycoserin-6alpha,7alpha-epoxid

C25H28O6 (424.1885788)


   

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

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

C25H28O6 (424.1885788)


   

(2R,3R)-3-geranyl-2,3-trans-5,7,4-trihydroxyflavonol

(2R,3R)-3-geranyl-2,3-trans-5,7,4-trihydroxyflavonol

C25H28O6 (424.1885788)


   
   

7,7-methanediylbis(3,4-dihydro-8-hydroxy-3,4,5-trimethyl-6H-isochromen-6-one)|dicitrinol|dicitrinone C

7,7-methanediylbis(3,4-dihydro-8-hydroxy-3,4,5-trimethyl-6H-isochromen-6-one)|dicitrinol|dicitrinone C

C25H28O6 (424.1885788)


   

2,3,4,4-tetrahydroxy-3-[6-hydroxy-3,7-dimethyl-2(E),7-octadienyl]chalcone

2,3,4,4-tetrahydroxy-3-[6-hydroxy-3,7-dimethyl-2(E),7-octadienyl]chalcone

C25H28O6 (424.1885788)


   
   
   
   

11beta-hydroxyleucodin 11-O-beta-D-glucopyranoside|11beta-hydroxyleucodin-11-O-beta-glucopyranoside|11beta-hydroxyleucodin-O-beta-D-glucopyranoside|11beta-hydroxyleukodin 11-O-beta-glucopyranoside|11??-Hydroxyleukodin 11-O-??-glucopyranoside

11beta-hydroxyleucodin 11-O-beta-D-glucopyranoside|11beta-hydroxyleucodin-11-O-beta-glucopyranoside|11beta-hydroxyleucodin-O-beta-D-glucopyranoside|11beta-hydroxyleukodin 11-O-beta-glucopyranoside|11??-Hydroxyleukodin 11-O-??-glucopyranoside

C21H28O9 (424.17332380000005)


   

beta-hydroxy-beta-methylglutaryl ester of 8-hydroxyabscisic acid

beta-hydroxy-beta-methylglutaryl ester of 8-hydroxyabscisic acid

C21H28O9 (424.17332380000005)


   

3,4,5,7-Tetrahydroxy-6,8-diprenyl-2,3-dihydroisoflavone

3,4,5,7-Tetrahydroxy-6,8-diprenyl-2,3-dihydroisoflavone

C25H28O6 (424.1885788)


   

8beta,9alpha-dihydroxy-5alpha,9betaH-lindan-4(15),7(13)-dien-8alpha,12-olide-8beta-O-beta-D-glucopyranoside|chloranthalactone E 8-O-beta-D-glucopyranoside

8beta,9alpha-dihydroxy-5alpha,9betaH-lindan-4(15),7(13)-dien-8alpha,12-olide-8beta-O-beta-D-glucopyranoside|chloranthalactone E 8-O-beta-D-glucopyranoside

C21H28O9 (424.17332380000005)


   

2-[3-(3-Methyl-2-butenyl)-4-hydroxyphenyl]-3,5,7-trihydroxy-8-(3-methyl-2-butenyl)-3,4-dihydro-2H-1-benzopyran-4-one

2-[3-(3-Methyl-2-butenyl)-4-hydroxyphenyl]-3,5,7-trihydroxy-8-(3-methyl-2-butenyl)-3,4-dihydro-2H-1-benzopyran-4-one

C25H28O6 (424.1885788)


   

dihydroisoplagiochin A

dihydroisoplagiochin A

C28H24O4 (424.1674504)


   

11-O-Demethylmarchantin I

11-O-Demethylmarchantin I

C28H24O4 (424.1674504)


   
   

3alpha-acetoxy-5beta-(4-acetoxytigloyloxy)-7-acetoxycarvotanacetone

3alpha-acetoxy-5beta-(4-acetoxytigloyloxy)-7-acetoxycarvotanacetone

C21H28O9 (424.17332380000005)


   
   
   
   
   

Doitunggarcinone C

Doitunggarcinone C

C25H28O6 (424.1885788)


   
   

4,5,7-trihydroxy-6-[6-hydroxy-3,7-dimethyl-2,7-octadienyl]flavanone|mimolone B

4,5,7-trihydroxy-6-[6-hydroxy-3,7-dimethyl-2,7-octadienyl]flavanone|mimolone B

C25H28O6 (424.1885788)


   

5,4-dihydroxy-6-(3-methylbut-2-enyl)-5-hydroxyisopropyldihydrofurano[2,3:7,8]isoflavone|isosenegalensein

5,4-dihydroxy-6-(3-methylbut-2-enyl)-5-hydroxyisopropyldihydrofurano[2,3:7,8]isoflavone|isosenegalensein

C25H28O6 (424.1885788)


   
   
   

1,5-dihydroxy-3,8-dimethoxy-2-(3,3-dimethyl-2-propenyl)-7-(3,3-dimethyl-2-propenyl)xanthone|phylattrin

1,5-dihydroxy-3,8-dimethoxy-2-(3,3-dimethyl-2-propenyl)-7-(3,3-dimethyl-2-propenyl)xanthone|phylattrin

C25H28O6 (424.1885788)


   
   
   

(+/-)-sepicanin A|Sophoroflavanone D

(+/-)-sepicanin A|Sophoroflavanone D

C25H28O6 (424.1885788)


   

CRATOXYARBORENONE C

CRATOXYARBORENONE C

C25H28O6 (424.1885788)


A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1 and 3, methoxy groups at positions 5 and 7 and two isoprenyl groups at positions 2 and 8 respectively. It is isolated from Cratoxylum Sumatranum and exhibits cytotoxicity towards the KB (human oral epidermoid) cancer cell line

   
   

Tricoccin S(4)|Tricoccin S4

Tricoccin S(4)|Tricoccin S4

C25H28O6 (424.1885788)


   

(-)-(7R,8R)-4,7,9,8,9-pentahydroxy-3,3,5-trimethoxy-8-O-4-neolignan|3-(4-{[(1R,2R)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3,5-dimethoxyphenyl)propane-1,2-diol|casearialignan D

(-)-(7R,8R)-4,7,9,8,9-pentahydroxy-3,3,5-trimethoxy-8-O-4-neolignan|3-(4-{[(1R,2R)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3,5-dimethoxyphenyl)propane-1,2-diol|casearialignan D

C21H28O9 (424.17332380000005)


   

2alpha-hydroperoxy-8-O-isobutyryl-9alpha-acetoxycumambrin B|2??-Hydroperoxy-8-O-isobutyryl-9??-acetoxycumambrin B

2alpha-hydroperoxy-8-O-isobutyryl-9alpha-acetoxycumambrin B|2??-Hydroperoxy-8-O-isobutyryl-9??-acetoxycumambrin B

C21H28O9 (424.17332380000005)


   
   
   

7-deacetyl-7-oxo-gedunin

7-deacetyl-7-oxo-gedunin

C25H28O6 (424.1885788)


   
   

8alpha-(4-hydroxymethacryloyloxy)-10alpha-hydroxy-1,13-dimethoxy-hirsutinolide

8alpha-(4-hydroxymethacryloyloxy)-10alpha-hydroxy-1,13-dimethoxy-hirsutinolide

C21H28O9 (424.17332380000005)


   

(+/-)-euchrestaflavanone B|(S)-form-Euchrestaflavanone B|5,7,2,4-tetrahydroxy-6,5-diprenylflavanone|cudraflavanone D|euchrestaflavanone B

(+/-)-euchrestaflavanone B|(S)-form-Euchrestaflavanone B|5,7,2,4-tetrahydroxy-6,5-diprenylflavanone|cudraflavanone D|euchrestaflavanone B

C25H28O6 (424.1885788)


   
   

3-(18,19-dihydro-19-hydroxygeranyloxy)-1,8-dihydroxy-6-methylanthraquinone|3-O-(3,7-dimethyl-7-hydroxyoct-2-enyl)-emodin

3-(18,19-dihydro-19-hydroxygeranyloxy)-1,8-dihydroxy-6-methylanthraquinone|3-O-(3,7-dimethyl-7-hydroxyoct-2-enyl)-emodin

C25H28O6 (424.1885788)


   
   
   
   
   
   

(1R*,4R*,8S*,10R*)-1,4-epoxy-1-ethoxy-8,13-diacetoxy-10-hydroxy-germacra-5E,7(11)-dien-6,12-olide

(1R*,4R*,8S*,10R*)-1,4-epoxy-1-ethoxy-8,13-diacetoxy-10-hydroxy-germacra-5E,7(11)-dien-6,12-olide

C21H28O9 (424.17332380000005)


   

5-geranyl-3,4,5,7-tetrahydroxyflavanone|5,7,3,4-tetrahydroxy-5-C-geranylflavanone|isonymphaeol-B|propolin F

5-geranyl-3,4,5,7-tetrahydroxyflavanone|5,7,3,4-tetrahydroxy-5-C-geranylflavanone|isonymphaeol-B|propolin F

C25H28O6 (424.1885788)


   

O1-Me,8-propanoyl,13-Ac-1,4-Epoxy-1,8,10,13-tetrahydroxy-5,7(11)-germacradien-12,6-olide

O1-Me,8-propanoyl,13-Ac-1,4-Epoxy-1,8,10,13-tetrahydroxy-5,7(11)-germacradien-12,6-olide

C21H28O9 (424.17332380000005)


   

Schizolaenone C

(2S)-2-(3,5-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


Schizolaenone C is a natural product found in Paulownia tomentosa with data available.

   
   
   

5,7,4-trihydroxy-3-(7-hydroxy-3,7-dimethyl-2(E)-octenyl)isoflavone

5,7,4-trihydroxy-3-(7-hydroxy-3,7-dimethyl-2(E)-octenyl)isoflavone

C25H28O6 (424.1885788)


   
   
   
   
   
   

3-geranyl-5,7,2,4-tetrahydroxyisoflavanone

3-geranyl-5,7,2,4-tetrahydroxyisoflavanone

C25H28O6 (424.1885788)


   

glyenflanin E|Glyinflanin E

glyenflanin E|Glyinflanin E

C25H28O6 (424.1885788)


   
   
   

KushenolE

4H-1-BENZOPYRAN-4-ONE, 2-(2,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-5,7-DIHYDROXY-6,8-BIS(3-METHYL-2-BUTEN-1-YL)-, (2S)-

C25H28O6 (424.1885788)


Kushenol E is a natural product found in Flemingia prostrata, Maclura cochinchinensis, and other organisms with data available. See also: Sophora tonkinensis root (part of).

   

MEGxp0_000008

2-[3,4-Dihydroxy-2,5-bis(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


2-[3,4-Dihydroxy-2,5-bis(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one is a natural product found in Erythrina abyssinica and Erythrina latissima with data available.

   

Cathayanon H

(2R,3R)-3,5,7-trihydroxy-2-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


Cathayanon H is a natural product found in Morus cathayana with data available.

   
   

3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

NCGC00385788-01!3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


   

(2R,3R)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

NCGC00385781-01!(2R,3R)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


   

2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

NCGC00385829-01!2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


   

C21H28O9_1-O-{[(3aS,6Z,10E,11aR)-10-Methyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-6-yl]carbonyl}-beta-D-glucopyranose

NCGC00385283-01_C21H28O9_1-O-{[(3aS,6Z,10E,11aR)-10-Methyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-6-yl]carbonyl}-beta-D-glucopyranose

C21H28O9 (424.17332380000005)


   

C21H28O9

NCGC00385202-01_C21H28O9_

C21H28O9 (424.17332380000005)


   

C21H28O9_2-Hydroxycyclohexyl 2-O-[(2E)-3-(4-hydroxyphenyl)-2-propenoyl]-beta-D-glucopyranoside

NCGC00384773-01_C21H28O9_2-Hydroxycyclohexyl 2-O-[(2E)-3-(4-hydroxyphenyl)-2-propenoyl]-beta-D-glucopyranoside

C21H28O9 (424.17332380000005)


   
   

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate

C21H28O9 (424.17332380000005)


   
   

2-oxapentacyclo[21.2.2.13,7.110,14.015,20]nonacosa-1(25),3,5,7(29),10(28),11,13,15(20),16,18,23,26-dodecaene-4,13,18-triol

2-oxapentacyclo[21.2.2.13,7.110,14.015,20]nonacosa-1(25),3,5,7(29),10(28),11,13,15(20),16,18,23,26-dodecaene-4,13,18-triol

C28H24O4 (424.1674504)


CONFIDENCE Predicted

   

Flavanone base + 4O, 2Prenyl

Flavanone base + 4O, 2Prenyl

C25H28O6 (424.1885788)


Annotation level-3

   

3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one [IIN-based on: CCMSLIB00000846382]

NCGC00385788-01!3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one [IIN-based on: CCMSLIB00000846382]

C25H28O6 (424.1885788)


   

3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one [IIN-based: Match]

NCGC00385788-01!3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one [IIN-based: Match]

C25H28O6 (424.1885788)


   
   

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_major

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_major

C21H28O9 (424.17332380000005)


   
   

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_7.2\\%

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_7.2\\%

C21H28O9 (424.17332380000005)


   

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_5.5\\%

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_5.5\\%

C21H28O9 (424.17332380000005)


   

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_4.0\\%

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,6Z,10E,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate_4.0\\%

C21H28O9 (424.17332380000005)


   
   

Loxoprofen Metabolite cis-glucuronide

Loxoprofen Metabolite cis-glucuronide

C21H28O9 (424.17332380000005)


   

Loxoprofen Metabolite trans-glucuronide

Loxoprofen Metabolite trans-glucuronide

C21H28O9 (424.17332380000005)


   

Ala Phe Gly Met

(2S)-2-{2-[(2S)-2-[(2S)-2-aminopropanamido]-3-phenylpropanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C19H28N4O5S (424.17803180000004)


   

Ala Phe Met Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Ala Gly Phe Met

(2S)-2-[(2S)-2-{2-[(2S)-2-aminopropanamido]acetamido}-3-phenylpropanamido]-4-(methylsulfanyl)butanoic acid

C19H28N4O5S (424.17803180000004)


   

Ala Gly Met Phe

(2S)-2-[(2S)-2-{2-[(2S)-2-aminopropanamido]acetamido}-4-(methylsulfanyl)butanamido]-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Ala Met Phe Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Ala Met Gly Phe

(2S)-2-{2-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]acetamido}-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Cys Phe Gly Val

(2S)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]acetamido}-3-methylbutanoic acid

C19H28N4O5S (424.17803180000004)


   

Cys Phe Val Gly

2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-methylbutanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Cys Gly Phe Val

(2S)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-phenylpropanamido]-3-methylbutanoic acid

C19H28N4O5S (424.17803180000004)


   

Cys Gly Val Phe

(2S)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-methylbutanamido]-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Cys Val Phe Gly

2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylbutanamido]-3-phenylpropanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Cys Val Gly Phe

(2S)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylbutanamido]acetamido}-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Asp Gly His Pro

(2S)-1-[(2S)-2-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C17H24N6O7 (424.17063939999997)


   

Asp Gly Pro His

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

C17H24N6O7 (424.17063939999997)


   

Asp His Gly Pro

(2S)-1-{2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]acetyl}pyrrolidine-2-carboxylic acid

C17H24N6O7 (424.17063939999997)


   

Asp His Pro Gly

(3S)-3-amino-3-{[(2S)-1-[(2S)-2-[(carboxymethyl)carbamoyl]pyrrolidin-1-yl]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]carbamoyl}propanoic acid

C17H24N6O7 (424.17063939999997)


   

Asp Pro Gly His

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

C17H24N6O7 (424.17063939999997)


   

Asp Pro His Gly

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

C17H24N6O7 (424.17063939999997)


   

Phe Ala Gly Met

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

C19H28N4O5S (424.17803180000004)


   

Phe Ala Met Gly

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

C19H28N4O5S (424.17803180000004)


   

Phe Cys Gly Val

(2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]acetamido}-3-methylbutanoic acid

C19H28N4O5S (424.17803180000004)


   

Phe Cys Val Gly

2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-methylbutanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Phe Gly Ala Met

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

C19H28N4O5S (424.17803180000004)


   

Phe Gly Cys Val

(2S)-2-[(2R)-2-{2-[(2S)-2-amino-3-phenylpropanamido]acetamido}-3-sulfanylpropanamido]-3-methylbutanoic acid

C19H28N4O5S (424.17803180000004)


   

Phe Gly Met Ala

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

C19H28N4O5S (424.17803180000004)


   

Phe Gly Val Cys

(2R)-2-[(2S)-2-{2-[(2S)-2-amino-3-phenylpropanamido]acetamido}-3-methylbutanamido]-3-sulfanylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Phe Met Ala Gly

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

C19H28N4O5S (424.17803180000004)


   

Phe Met Gly Ala

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

C19H28N4O5S (424.17803180000004)


   

Phe Val Cys Gly

2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-methylbutanamido]-3-sulfanylpropanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Phe Val Gly Cys

(2R)-2-{2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-methylbutanamido]acetamido}-3-sulfanylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Gly Ala Phe Met

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

C19H28N4O5S (424.17803180000004)


   

Gly Ala Met Phe

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

C19H28N4O5S (424.17803180000004)


   

Gly Cys Phe Val

(2S)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-3-phenylpropanamido]-3-methylbutanoic acid

C19H28N4O5S (424.17803180000004)


   

Gly Cys Val Phe

(2S)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-3-methylbutanamido]-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Gly Asp His Pro

(2S)-1-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C17H24N6O7 (424.17063939999997)


   

Gly Asp Pro His

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

C17H24N6O7 (424.17063939999997)


   

Gly Phe Ala Met

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

C19H28N4O5S (424.17803180000004)


   

Gly Phe Cys Val

(2S)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-3-phenylpropanamido]-3-sulfanylpropanamido]-3-methylbutanoic acid

C19H28N4O5S (424.17803180000004)


   

Gly Phe Met Ala

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

C19H28N4O5S (424.17803180000004)


   

Gly Phe Val Cys

(2R)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-phenylpropanamido]-3-methylbutanamido]-3-sulfanylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Gly His Asp Pro

(2S)-1-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanoyl]pyrrolidine-2-carboxylic acid

C17H24N6O7 (424.17063939999997)


   

Gly His Pro Asp

(2S)-2-{[(2S)-1-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}butanedioic acid

C17H24N6O7 (424.17063939999997)


   

Gly Met Ala Phe

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

C19H28N4O5S (424.17803180000004)


   

Gly Met Phe Ala

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

C19H28N4O5S (424.17803180000004)


   

Gly Pro Asp His

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

C17H24N6O7 (424.17063939999997)


   

Gly Pro His Asp

(2S)-2-[(2S)-2-{[(2S)-1-(2-aminoacetyl)pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C17H24N6O7 (424.17063939999997)


   

Gly Val Cys Phe

(2S)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-3-methylbutanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Gly Val Phe Cys

(2R)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-methylbutanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

His Asp Gly Pro

(2S)-1-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]acetyl}pyrrolidine-2-carboxylic acid

C17H24N6O7 (424.17063939999997)


   

His Asp Pro Gly

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

C17H24N6O7 (424.17063939999997)


   

His Gly Asp Pro

(2S)-1-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-carboxypropanoyl]pyrrolidine-2-carboxylic acid

C17H24N6O7 (424.17063939999997)


   

His Gly Pro Asp

(2S)-2-{[(2S)-1-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetyl}pyrrolidin-2-yl]formamido}butanedioic acid

C17H24N6O7 (424.17063939999997)


   

His Pro Asp Gly

(3S)-3-{[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-[(carboxymethyl)carbamoyl]propanoic acid

C17H24N6O7 (424.17063939999997)


   

His Pro Gly Asp

(2S)-2-(2-{[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}acetamido)butanedioic acid

C17H24N6O7 (424.17063939999997)


   
   
   

Met Ala Phe Gly

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

C19H28N4O5S (424.17803180000004)


   

Met Ala Gly Phe

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

C19H28N4O5S (424.17803180000004)


   

Met Phe Ala Gly

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

C19H28N4O5S (424.17803180000004)


   

Met Phe Gly Ala

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

C19H28N4O5S (424.17803180000004)


   

Met Gly Ala Phe

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

C19H28N4O5S (424.17803180000004)


   

Met Gly Phe Ala

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

C19H28N4O5S (424.17803180000004)


   
   

β-D-Glucopyranosiduronic acid, 2-(1H-indol-4-yloxy)-1-[[(1-methylethyl)amino]methyl]ethyl

β-D-Glucopyranosiduronic acid, 2-(1H-indol-4-yloxy)-1-[[(1-methylethyl)amino]methyl]ethyl

C20H28N2O8 (424.1845568)


   

Pro Asp Gly His

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

C17H24N6O7 (424.17063939999997)


   

Pro Asp His Gly

(3S)-3-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-3-[(2S)-pyrrolidin-2-ylformamido]propanoic acid

C17H24N6O7 (424.17063939999997)


   

Pro Gly Asp His

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

C17H24N6O7 (424.17063939999997)


   

Pro Gly His Asp

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

C17H24N6O7 (424.17063939999997)


   

Pro His Asp Gly

(3S)-3-[(carboxymethyl)carbamoyl]-3-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]propanoic acid

C17H24N6O7 (424.17063939999997)


   

Pro His Gly Asp

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

C17H24N6O7 (424.17063939999997)


   
   

Val Cys Phe Gly

2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-methylbutanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Val Cys Gly Phe

(2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-methylbutanamido]-3-sulfanylpropanamido]acetamido}-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Val Phe Cys Gly

2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]acetic acid

C19H28N4O5S (424.17803180000004)


   

Val Phe Gly Cys

(2R)-2-{2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-phenylpropanamido]acetamido}-3-sulfanylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Val Gly Cys Phe

(2S)-2-[(2R)-2-{2-[(2S)-2-amino-3-methylbutanamido]acetamido}-3-sulfanylpropanamido]-3-phenylpropanoic acid

C19H28N4O5S (424.17803180000004)


   

Val Gly Phe Cys

(2R)-2-[(2S)-2-{2-[(2S)-2-amino-3-methylbutanamido]acetamido}-3-phenylpropanamido]-3-sulfanylpropanoic acid

C19H28N4O5S (424.17803180000004)


   
   

Sigmoidin A

Sigmoidin A

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 4 and prenyl groups at positions 2 and 5. Isolated from Erythrina sigmoidea, it exhibits anti-inflammatory and antioxidant activities.

   
   

Lespedezaflavanone D

Lespedezaflavanone D

C25H28O6 (424.1885788)


   

Dulxanthone C

1,5-dihydroxy-3,6-dimethoxy-4,8-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one

C25H28O6 (424.1885788)


   

Taraxinic acid glucosyl ester

3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 10-methyl-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-6-carboxylate

C21H28O9 (424.17332380000005)


   

β-Mangostin

1,6-DIHYDROXY-3,7-DIMETHOXY-2,8-BIS(3-METHYLBUT-2-EN-1-YL)-9H-XANTHEN-9-ONE

C25H28O6 (424.1885788)


beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4]. beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4].

   

3-Methyl-2-butenyl-(-)-piperitol

5-[4-(3-methoxy-4-{[(1Z)-3-methylbut-1-en-1-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2H-1,3-benzodioxole

C25H28O6 (424.1885788)


   

1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone

1,7-dihydroxy-3,6-dimethoxy-2,8-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one

C25H28O6 (424.1885788)


   

Sophoraflavanone G

Sophoraflavanone G

C25H28O6 (424.1885788)


   
   

Calix[4]arene

Calix[4]arene-25,26,27,28-tetrol

C28H24O4 (424.1674504)


   

sodium 2-[2-[2-(octylphenoxy)ethoxy]ethoxy]ethanesulphonate

sodium 2-[2-[2-(octylphenoxy)ethoxy]ethoxy]ethanesulphonate

C20H33NaO6S (424.1895438000001)


   
   
   

sodium 2-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethoxy]ethanesulphonate

sodium 2-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethoxy]ethanesulphonate

C20H33NaO6S (424.1895438000001)


   

Unii-QI52W1ziib

Unii-QI52W1ziib

C26H24N4O2 (424.18991639999996)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C155764 - AKT Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor

   

N,N-Diacetylchitobiose

di(N-acetyl-D-glucosamine)

C16H28N2O11 (424.16930179999997)


The N,N-diacetylated derivative of chitobiose, but with no stereodesignation for the anomeric carbon atom. N,N'-Diacetylchitobiose is a dimer of β(1,4) linked N-acetyl-D glucosamine. N,N'-Diacetylchitobiose is the hydrolysate of chitin and can be used as alternative carbon source by?E. coli[1].

   

Anileridine hydrochloride

Anileridine hydrochloride

C22H30Cl2N2O2 (424.16842199999996)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent

   

(3S,4S,5S)-3-amino-4,5-dihydroxy-6-[[(1S)-1-[(3S)-8-hydroxy-1-oxo-3,4-dihydroisochromen-3-yl]-3-methylbutyl]amino]-6-oxohexanoic acid

(3S,4S,5S)-3-amino-4,5-dihydroxy-6-[[(1S)-1-[(3S)-8-hydroxy-1-oxo-3,4-dihydroisochromen-3-yl]-3-methylbutyl]amino]-6-oxohexanoic acid

C20H28N2O8 (424.1845568)


   

GlcNAc1-beta-3GalNAc

2-Acetamido-2-deoxy-3-O-(2-acetamido-2-deoxy-B-D-glucopyranosyl)-D-galactopyranose

C16H28N2O11 (424.16930179999997)


   

nymphaeol B

nymphaeol B

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy group at positions 5, 7, 3 and 4 and a geranyl group at position 2. Isolated from Macaranga tanarius and propolis collected in Okinawa, it exhibits radical scavenging activity.

   
   
   
   

3-[3-(N-ethylanilino)propyl]-6-(4-morpholinyl)-2-sulfanylidene-1H-quinazolin-4-one

3-[3-(N-ethylanilino)propyl]-6-(4-morpholinyl)-2-sulfanylidene-1H-quinazolin-4-one

C23H28N4O2S (424.1932868)


   
   

beta-D-GlcpNAc-(1->6)-D-GalpNAc

beta-D-GlcpNAc-(1->6)-D-GalpNAc

C16H28N2O11 (424.16930179999997)


An amino disaccharide consisting of N-acetyl-D-galactosamine having a N-acetyl-beta-D-glucosaminyl residue attached at the 6-position.

   

2-Acetamido-6-O-(2-acetamido-2-deoxy-a-D-galactopyranosyl)-2-deoxy-D-galactopyranose

2-Acetamido-6-O-(2-acetamido-2-deoxy-a-D-galactopyranosyl)-2-deoxy-D-galactopyranose

C16H28N2O11 (424.16930179999997)


   

2-Acetamido-4-O-(2-acetamido-2-deoxy-a-D-galactopyranosyl)-2-deoxy-D-galactopyranose

2-Acetamido-4-O-(2-acetamido-2-deoxy-a-D-galactopyranosyl)-2-deoxy-D-galactopyranose

C16H28N2O11 (424.16930179999997)


   

SPIRADOLINE

SPIRADOLINE

C22H30Cl2N2O2 (424.16842199999996)


D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D045283 - Natriuretic Agents > D004232 - Diuretics

   

12-(2-hydroxyethyl)-2-(1-methylethoxy)-13,14-dihydronaphtho[2,1-a]pyrrolo[3,4-c]carbazol-5(12H)-one

12-(2-hydroxyethyl)-2-(1-methylethoxy)-13,14-dihydronaphtho[2,1-a]pyrrolo[3,4-c]carbazol-5(12H)-one

C27H24N2O3 (424.17868339999995)


   

(4,11-Diacetyloxy-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-2-yl)methyl acetate

(4,11-Diacetyloxy-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-2-yl)methyl acetate

C21H28O9 (424.17332380000005)


   
   
   

2-(3,5-Dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

2-(3,5-Dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

C25H28O6 (424.1885788)


   

Nymphaeol A

Nymphaeol A

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy group at positions 5, 7, 3 and 4 and a geranyl group at position 6. Isolated from Macaranga tanarius and propolis collected in Okinawa, it exhibits radical scavenging activity.

   
   

[(2R,4S,10R,11S)-10,11-diacetyloxy-4-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-2-yl]methyl acetate

[(2R,4S,10R,11S)-10,11-diacetyloxy-4-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-2-yl]methyl acetate

C21H28O9 (424.17332380000005)


   
   

(2S,3S,6R)-3-[[(3S)-3-azaniumyl-5-[diaminomethylidene(methyl)azaniumyl]pentanoyl]amino]-6-(2,4-dioxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-2-carboxylate

(2S,3S,6R)-3-[[(3S)-3-azaniumyl-5-[diaminomethylidene(methyl)azaniumyl]pentanoyl]amino]-6-(2,4-dioxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-2-carboxylate

C17H26N7O6+ (424.1944476)


   

[(3S)-3-amino-5-[[(2S,3S,6R)-2-carboxy-6-(2,4-dioxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-3-yl]amino]-5-oxopentyl]-(diaminomethylidene)-methylazanium

[(3S)-3-amino-5-[[(2S,3S,6R)-2-carboxy-6-(2,4-dioxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-3-yl]amino]-5-oxopentyl]-(diaminomethylidene)-methylazanium

C17H26N7O6+ (424.1944476)


   

2-(3,4-dichlorophenyl)-N-methyl-N-[7-(pyrrolidin-1-yl)-1-oxaspiro[4.5]decan-8-yl]acetamide

2-(3,4-dichlorophenyl)-N-methyl-N-[7-(pyrrolidin-1-yl)-1-oxaspiro[4.5]decan-8-yl]acetamide

C22H30Cl2N2O2 (424.16842199999996)


   

beta-D-GalpNAc-(1->4)-beta-D-GlcpNAc

beta-D-GalpNAc-(1->4)-beta-D-GlcpNAc

C16H28N2O11 (424.16930179999997)


beta-D-GalpNAc-(1->4)-D-GlcpNAc with beta configuration at the anomeric centre.

   

(2S)-5,7,3,5-tetrahydroxy-8-[3,8-dimethylocta-2(E),7-dienyl]flavonone

(2S)-5,7,3,5-tetrahydroxy-8-[3,8-dimethylocta-2(E),7-dienyl]flavonone

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 5 and a geranyl group at position 8. Isolated from Macaranga bicolor, it exhibits inhibitory activity against breast cancer resistance protein.

   

Isonymphaeol B

Isonymphaeol B

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 4 and a geranyl group at position 5. Isolated from Propolis from Okinawa, Japan, it exhibits radical scavenging activity.

   
   
   

beta-D-GlcpNAc-(1->3)-alpha-D-GalpNAc

beta-D-GlcpNAc-(1->3)-alpha-D-GalpNAc

C16H28N2O11 (424.16930179999997)


An amino disaccharide comprising an N-acetyl-beta-D-glucosamine residue linked (1->3) to an N-acetyl-beta-D-galactosamine residue at the reducing end.

   

beta-D-GlcpNAc-(1->6)-alpha-D-GalpNAc

beta-D-GlcpNAc-(1->6)-alpha-D-GalpNAc

C16H28N2O11 (424.16930179999997)


beta-D-GlcpNAc-(1->6)-D-GalpNAc in which the anomeric configuration of the reducing-end GalNAc residue is alpha.

   

N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-alpha-D-glucosamine

N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-alpha-D-glucosamine

C16H28N2O11 (424.16930179999997)


   
   

N-[1-(3-methoxyphenyl)-3-(1-naphthalenylamino)-3-oxopropyl]benzamide

N-[1-(3-methoxyphenyl)-3-(1-naphthalenylamino)-3-oxopropyl]benzamide

C27H24N2O3 (424.17868339999995)


   

methyl 3-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]amino]-6-methyl-1H-indole-2-carboxylate

methyl 3-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]amino]-6-methyl-1H-indole-2-carboxylate

C22H24N4O5 (424.1746614)


   

7-[[1-(2-oxolanylmethyl)-5-tetrazolyl]-(1-pyrrolidinyl)methyl]-5H-[1,3]dioxolo[4,5-g]quinolin-6-one

7-[[1-(2-oxolanylmethyl)-5-tetrazolyl]-(1-pyrrolidinyl)methyl]-5H-[1,3]dioxolo[4,5-g]quinolin-6-one

C21H24N6O4 (424.1858944)


   

3-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one

3-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one

C23H28N4O2S (424.1932868)


   
   

2-Acetamido-6-O-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose

2-Acetamido-6-O-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose

C16H28N2O11 (424.16930179999997)


   

(2S,4R)-N-[(1S,2S)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylthio)-2-oxanyl]propyl]-1-methyl-4-propyl-2-pyrrolidinecarboxamide

(2S,4R)-N-[(1S,2S)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylthio)-2-oxanyl]propyl]-1-methyl-4-propyl-2-pyrrolidinecarboxamide

C18H33ClN2O5S (424.17985980000003)


   
   
   
   
   

deaminohydroxyblasticidin S cation

deaminohydroxyblasticidin S cation

C17H26N7O6+ (424.1944476)


   

1,7-Bis(3,4-dimethoxyphenyl)-4,4-dimethylhepta-1,6-diene-3,5-dione

1,7-Bis(3,4-dimethoxyphenyl)-4,4-dimethylhepta-1,6-diene-3,5-dione

C25H28O6 (424.1885788)


   
   
   
   
   

N-acetyl-D-galactosaminyl-(1->3)-N-acetyl-D-galactosamine

N-acetyl-D-galactosaminyl-(1->3)-N-acetyl-D-galactosamine

C16H28N2O11 (424.16930179999997)


   

beta-D-GalpNAc-(1->3)-alpha-D-GalpNAc

beta-D-GalpNAc-(1->3)-alpha-D-GalpNAc

C16H28N2O11 (424.16930179999997)


An amino disaccharide comprised of N-acetyl-alpha-D-galactosamine having an N-acetyl-D-galactosaminyl residue attached at the 3-position via a beta-linkage.

   

2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-galactopyranosyl)-2-deoxy-alpha-D-galactopyranose

2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-galactopyranosyl)-2-deoxy-alpha-D-galactopyranose

C16H28N2O11 (424.16930179999997)


   
   
   
   

1,3-benzodioxol-5-yl-[(1R,5S)-7-[4-[(E)-2-phenylethenyl]phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone

1,3-benzodioxol-5-yl-[(1R,5S)-7-[4-[(E)-2-phenylethenyl]phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone

C27H24N2O3 (424.17868339999995)


   

N-[(2S,3R,6S)-2-(hydroxymethyl)-6-(2-oxo-2-piperidin-1-ylethyl)-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2S,3R,6S)-2-(hydroxymethyl)-6-(2-oxo-2-piperidin-1-ylethyl)-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2R,3R,6R)-2-(hydroxymethyl)-6-(2-oxo-2-piperidin-1-ylethyl)-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2R,3R,6R)-2-(hydroxymethyl)-6-(2-oxo-2-piperidin-1-ylethyl)-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2R,3S,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2R,3S,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H29ClN2O5 (424.17648940000004)


   

2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2S,3R,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

N-[(2S,3R,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

C21H29ClN2O5 (424.17648940000004)


   

N-[(2S,3R,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

N-[(2S,3R,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

C21H29ClN2O5 (424.17648940000004)


   

N-[(2S,3S,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2S,3S,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H29ClN2O5 (424.17648940000004)


   

2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2R,3S,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2R,3S,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H29ClN2O5 (424.17648940000004)


   

N-[(2R,3R,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2R,3R,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H29ClN2O5 (424.17648940000004)


   

2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

[(1S,2aR,8bR)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

[(1S,2aR,8bR)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

C24H25FN2O4 (424.1798262)


   

[(1R,2aR,8bR)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

[(1R,2aR,8bR)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

C24H25FN2O4 (424.1798262)


   

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

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

C24H28N2O3S (424.18205380000006)


   

(1S,5R)-7-[4-(3-cyanophenyl)phenyl]-N-(2-methoxyphenyl)-3,6-diazabicyclo[3.1.1]heptane-3-carboxamide

(1S,5R)-7-[4-(3-cyanophenyl)phenyl]-N-(2-methoxyphenyl)-3,6-diazabicyclo[3.1.1]heptane-3-carboxamide

C26H24N4O2 (424.18991639999996)


   

(1R)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide

(1R)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide

C23H25FN4O3 (424.1910591999999)


   

N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxybenzenesulfonamide

C20H28N2O6S (424.16679880000004)


   

N-[(2S,3S,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2S,3S,6R)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H29ClN2O5 (424.17648940000004)


   

N-[(2R,3R,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2R,3R,6S)-6-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H29ClN2O5 (424.17648940000004)


   

2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-cyclopentylacetamide

C20H28N2O6S (424.16679880000004)


   

[(1S,2aS,8bS)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

[(1S,2aS,8bS)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

C24H25FN2O4 (424.1798262)


   

[(1R,2aS,8bS)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

[(1R,2aS,8bS)-4-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-oxanyl)methanone

C24H25FN2O4 (424.1798262)


   

(1S)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide

(1S)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide

C23H25FN4O3 (424.1910591999999)


   
   
   

arugosin A (hydroxy-aldehyde form)

arugosin A (hydroxy-aldehyde form)

C25H28O6 (424.1885788)


A member of the class of benzophenones that is benzophenone in which one of the phenyl groups is substituted by a 3,3-dimethylallyl group at position 3 and by hydroxy groups at positions 2 and 6, while the other is substituted by a formyl group at position 2, a 3,3-dimethylallyloxy group at position 3, a methyl group at position 4, and a hydroxy group at position 6.

   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   

2-acetamido-2-deoxy-D-gluco-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose

2-acetamido-2-deoxy-D-gluco-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose

C16H28N2O11 (424.16930179999997)


   

[2-butyl-5-chloro-3-[[4-[2-(2,3-dihydro-1H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazol-4-yl]methanol

[2-butyl-5-chloro-3-[[4-[2-(2,3-dihydro-1H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazol-4-yl]methanol

C22H25ClN6O (424.177827)


   

(3alpha)-3-Hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate

(3alpha)-3-Hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate

C21H28O9 (424.17332380000005)


   
   

3-Hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate

3-Hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate

C21H28O9 (424.17332380000005)


   

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,10Z,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (3aS,10Z,11aR)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-carboxylate

C21H28O9 (424.17332380000005)


   

(2S,4R)-N-[(1R)-2-chloro-1-[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide

(2S,4R)-N-[(1R)-2-chloro-1-[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide

C18H33ClN2O5S (424.17985980000003)


   

platencin(1-)

platencin(1-)

C24H26NO6 (424.17600360000006)


A monocarboxylic acid anion that is the conjugate base of platencin resulting from the deprotonation of the carboxy group; major species at pH 7.3.

   
   

Cleocin

Cleocin

C18H33ClN2O5S (424.17985980000003)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D055231 - Lincosamides D004791 - Enzyme Inhibitors > D011500 - Protein Synthesis Inhibitors

   

beta-D-GalpNAc-(1->4)-D-GlcpNAc

beta-D-GalpNAc-(1->4)-D-GlcpNAc

C16H28N2O11 (424.16930179999997)


An amino disaccharide consisting of N-acetylglucosamine having an N-acetylgalactosaminyl resiude attached at the 4-position via a beta-linkage.

   

N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-aldehydo-D-glucosamine

N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-aldehydo-D-glucosamine

C16H28N2O11 (424.16930179999997)


   

alpha-D-GalpNAc-(1->4)-beta-D-GlcpNAc

alpha-D-GalpNAc-(1->4)-beta-D-GlcpNAc

C16H28N2O11 (424.16930179999997)


An alpha-D-GalpNAc-(1->4)-D-GlcpNAc in which the reducing end anomeric centre has beta-configuration.

   

D-GalpNAc-(1->3)-D-GalpNAc

D-GalpNAc-(1->3)-D-GalpNAc

C16H28N2O11 (424.16930179999997)


A disaccharide composed of two 2-(acetylamino)-2-deoxy-D-galactopyranose units in (1->3) linkage.

   

2-Acetamido-2-deoxy-3-O-(2-acetamido-2-deoxy-B-D-glucopyranosyl)-D-galactopyranose

2-Acetamido-2-deoxy-3-O-(2-acetamido-2-deoxy-B-D-glucopyranosyl)-D-galactopyranose

C16H28N2O11 (424.16930179999997)


   

beta-D-GalpNAc-(1->4)-alpha-D-GalpNAc

beta-D-GalpNAc-(1->4)-alpha-D-GalpNAc

C16H28N2O11 (424.16930179999997)


An amino disaccharide comprised of N-acetyl-alpha-D-galactosamine having an N-acetyl-D-galactosaminyl residue attached at the 4-position via a beta-linkage. Important epitope forming part of the O-polysaccharides of some Gram-negative bacteria.

   

alpha-D-GalpNAc-(1->3)-D-GalpNAc

alpha-D-GalpNAc-(1->3)-D-GalpNAc

C16H28N2O11 (424.16930179999997)


An amino disaccharide consisting of two N-acetyl-D-galactosamine units joined via an alpha-(1->3)-linkage.

   

alpha-D-GalpNAc-(1->4)-D-GlcpNAc

alpha-D-GalpNAc-(1->4)-D-GlcpNAc

C16H28N2O11 (424.16930179999997)


An amino disaccharide consisting of N-acetyl-D-glucosamine having an N-acetyl-alpha-D-galactosminyl resiude attached at the 4-position.

   

(S)-2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)chroman-4-one

(S)-2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)chroman-4-one

C25H28O6 (424.1885788)


A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 5 and prenyl groups at positions 6 and 8 respectively. It has been isolated from natural product found in Macaranga conifera.

   

alpha-D-GalNpAc-(1->3)-beta-D-GalpNAc

alpha-D-GalNpAc-(1->3)-beta-D-GalpNAc

C16H28N2O11 (424.16930179999997)


An alpha-D-GalpNAc-(1->3)-D-GalpNAc having beta-configuration at the reducing end anomeric centre.

   

clindamycin

clindamycin

C18H33ClN2O5S (424.17985980000003)


A carbohydrate-containing antibiotic that is the semisynthetic derivative of lincomycin, a natural antibiotic.

   

N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosamine

N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosamine

C16H28N2O11 (424.16930179999997)


An N,N-diacetylchitobiose having beta-configuration at the reducing end anomeric centre.

   
   
   
   

5-LOX-IN-4

5-LOX-IN-4

C23H28N4O2S (424.1932868)


5-LOX-IN-4 is a 5-Lipoxygenase inhibitor extracted from patent EP 331232 A2, table 4, compound example 4.10.