Exact Mass: 372.06846060000004

Exact Mass Matches: 372.06846060000004

Found 251 metabolites which its exact mass value is equals to given mass value 372.06846060000004, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

2-O-caffeoylglucarate

2-O-caffeoylglucaric acid

C15H16O11 (372.0692586)


   
   

Dothistromin

Anthra(2,3-b)furo(3,2-d)furan-5,10-dione, 2,3,3a,12a-tetrahydro-2,3a,4,6,9-pentahydroxy-, (2R,3aR,12aS)-

C18H12O9 (372.0481302)


   

QUIZALOFOP-ETHYL

Ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid

C19H17ClN2O4 (372.0876792)


CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10197; ORIGINAL_PRECURSOR_SCAN_NO 10195 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10169; ORIGINAL_PRECURSOR_SCAN_NO 10168 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10194; ORIGINAL_PRECURSOR_SCAN_NO 10192 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10142; ORIGINAL_PRECURSOR_SCAN_NO 10140 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10217; ORIGINAL_PRECURSOR_SCAN_NO 10216 ORIGINAL_ACQUISITION_NO 10194; CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 10192 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10226; ORIGINAL_PRECURSOR_SCAN_NO 10224 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

MBTA

4-(N-Maleimido)benzyltrimethylammonium iodide

C14H17IN2O2 (372.0334732)


   

Gomphidic acid

2-[(2Z)-3-hydroxy-5-oxo-4-(3,4,5-trihydroxyphenyl)-2,5-dihydrofuran-2-ylidene]-2-(4-hydroxyphenyl)acetic acid

C18H12O9 (372.0481302)


Gomphidic acid is found in mushrooms. Gomphidic acid is a pigment from the lichen Gomphidius glutinosus (spike cap). Pigment from the lichen Gomphidius glutinosus (spike cap). Gomphidic acid is found in mushrooms.

   

Veranisatin C

Methyl 4,5,7,11-tetrahydroxy-2-methyl-4,10-dioxo-9-oxaspiro[oxetane-3,6-tricyclo[6.3.1.0¹,⁵]dodecane]-7-carboxylic acid

C16H20O10 (372.105642)


Veranisatin C is found in fruits. Veranisatin C is a constituent of Illicium verum (Chinese star anise)

   

Dihydroferulic acid 4-O-glucuronide

(2S,3S,4S,5R,6S)-6-[4-(2-carboxyethyl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C16H20O10 (372.105642)


Dihydroferulic acid 4-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).

   

Sulindac sulfone

2-{5-fluoro-1-[(4-methanesulfonylphenyl)methylidene]-2-methyl-1H-inden-3-yl}acetic acid

C20H17FO4S (372.0831534)


Sulindac sulfone is a metabolite of sulindac. Sulindac is a non-steroidal anti-inflammatory drug of the arylalkanoic acid class that is marketed in the UK & U.S. by Merck as Clinoril. (Wikipedia)

   

Pamoic acid

4-[(3-formyl-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid

C23H16O5 (372.0997686)


Pamoic acid, also known as pamoate, belongs to the class of organic compounds known as naphthalenecarboxylic acids. Naphthalenecarboxylic acids are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring. Pamoic acid is considered to be a practically insoluble (in water) and relatively neutral molecule.

   

Dihydroisoferulic acid 3-glucuronide

(2S,3S,4S,5R,6S)-6-[5-(2-carboxyethyl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C16H20O10 (372.105642)


   

Eckol

1-(3,5-dihydroxyphenoxy)-2,4,7,9-tetrahydroxydibenzo-1,4-dioxin

C18H12O9 (372.0481302)


   

Glafenine

4-(2-beta,gamma-Dihydroxypropoxycarbonylphenylamino)-7-chloroquinoline

C19H17ClN2O4 (372.0876792)


D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics N - Nervous system > N02 - Analgesics

   

Hydroxypioglitazone

5-[(4-{2-[5-(1-hydroxyethyl)pyridin-2-yl]ethoxy}phenyl)methyl]-1,3-thiazolidine-2,4-dione

C19H20N2O4S (372.11437200000006)


C78272 - Agent Affecting Nervous System

   

(5Z)-5-[(2-Benzyl-5-hydroxy-4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-5-[(2-Benzyl-5-hydroxy-4-nitrophenyl)methylidene]-2-sulphanylidene-1,3-thiazolidin-4-one

C17H12N2O4S2 (372.0238472)


   

Edetate disodium

disodium 2-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetate dihydrate

C10H18N2Na2O10 (372.0756808)


Preservative and sequestrant in foods. Ethylenediaminetetraacetic acid, widely abbreviated as EDTA, is a polyamino carboxylic acid and a colourless, water-soluble solid. Its conjugate base is named ethylenediaminetetraacetate. It is widely used to dissolve limescale. Its usefulness arises because of its role as a hexadentate (six-toothed") ligand and chelating agent Preservative and sequestrant in foods

   

3-butenylglucosinolate

(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulphanyl}pent-4-en-1-ylidene)amino sulphuric acid

C11H18NO9S2 (372.0422958)


3-butenylglucosinolate is soluble (in water) and an extremely strong acidic compound (based on its pKa). 3-butenylglucosinolate can be found in a number of food items such as kohlrabi, american cranberry, linden, and lemon balm, which makes 3-butenylglucosinolate a potential biomarker for the consumption of these food products.

   

Norstictic acid

Norstictic acid

C18H12O9 (372.0481302)


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

   
   
   
   

(+)-Usararotenoid B

(+)-Usararotenoid B

C19H16O8 (372.0845136)


   

Deacetyl asperuloside

Deacetyl asperuloside

C16H20O10 (372.105642)


   

Repenol

6a,12a-Dehydro-3,9,10,11-tetrahydroxy-6-acetoxyrotenone

C18H12O9 (372.0481302)


   

5-Hydroxy-3,4,5-trimethoxy-6,7-methylenedioxyisoflavone

5-Hydroxy-3,4,5-trimethoxy-6,7-methylenedioxyisoflavone

C19H16O8 (372.0845136)


   

Lophirone I

(S) -2,3-Dihydro-7-hydroxy-2- [ 2- (4-hydroxyphenyl) -5-benzofuranyl ] -4H-1-benzopyran-4-one

C23H16O5 (372.0997686)


   

Stemonal

6,11-Dihydroxy-2,3,9-trimethoxy [ 1 ] benzopyrano [ 3,4-b ] [ 1 ] benzopyran-12 (6H) -one

C19H16O8 (372.0845136)


   
   

4-Hydroxy-5,6,7-trimethoxy-3-(3,4-methylenedioxy)phenylcoumarin

4-Hydroxy-5,6,7-trimethoxy-3-(3,4-methylenedioxy)phenylcoumarin

C19H16O8 (372.0845136)


   
   
   

Herbacetin 7,4-dimethyl ether 8-acetate

3,5,8-Trihydroxy-7,4-dimethoxyflavone 8-acetate

C19H16O8 (372.0845136)


   

5-O-trans-Caffeoylgalactaric acid

5-O-trans-Caffeoylgalactaric acid

C15H16O11 (372.0692586)


   

Melisimplin

2-(1,3-Benzodioxol-5-yl)-5-hydroxy-3,6,7-trimethoxy-4H-1-benzopyran-4-one

C19H16O8 (372.0845136)


   

7-Hydroxy-3,5,8-trimethoxy-3,4-methylenedioxyflavone

2- (1,3-Benzodioxol-5-yl) -7-hydroxy-3,5,8-trimethoxy-4H-1-benzopyran-4-one

C19H16O8 (372.0845136)


   

5-Hydroxy-3,7,8-trimethoxy-3,4-methylenedioxyflavone

2- (1,3-Benzodioxol-5-yl) -5-hydroxy-3,7,8-trimethoxy-4H-1-benzopyran-4-one

C19H16O8 (372.0845136)


   

Quercetin 3-isobutyrate

3,5,7,3,4-Pentahydroxyflavone 3-isobutyrate

C19H16O8 (372.0845136)


   

Quercetin 4-isobutyrate

3,5,7,3,4-Pentahydroxyflavone 4-isobutyrate

C19H16O8 (372.0845136)


   

glafenine

glafenine

C19H17ClN2O4 (372.0876792)


D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics N - Nervous system > N02 - Analgesics

   

Mefenpyr-diethyl

Mefenpyr-diethyl

C16H18Cl2N2O4 (372.06435680000004)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 3169

   

Proquinazid

Proquinazid

C14H17IN2O2 (372.0334732)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 3491

   

7-chloro-4,6-dimethoxy-3a,12a-dihydro-5h-furo[3,2:4,5]furo[3,2-b]xanthen-5-one

7-chloro-4,6-dimethoxy-3a,12a-dihydro-5h-furo[3,2:4,5]furo[3,2-b]xanthen-5-one

C19H13ClO6 (372.04006280000004)


   
   

(2S,3S,4S,5R,6R)-6-(3-benzoyloxy-2-hydroxypropoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

(2S,3S,4S,5R,6R)-6-(3-benzoyloxy-2-hydroxypropoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C16H20O10 (372.105642)


   
   
   

5aH-6,11:11,13a-Diepoxy-10,11,12,13-tetrahydro-1,5a,10-trihydroxy-9-methylcyclodeca[b]naphthalene-5,7,14(6H)-trione

5aH-6,11:11,13a-Diepoxy-10,11,12,13-tetrahydro-1,5a,10-trihydroxy-9-methylcyclodeca[b]naphthalene-5,7,14(6H)-trione

C19H16O8 (372.0845136)


   

4-Phenyl-5-methoxy-7-hydroxy-8-benzoylcoumarin

4-Phenyl-5-methoxy-7-hydroxy-8-benzoylcoumarin

C23H16O5 (372.0997686)


   

5,5,6,6-Tetrahydro-6,6-cyclo-5,5-bi[7H-furo[3,2-g][1]benzopyran]-7,7-dione

5,5,6,6-Tetrahydro-6,6-cyclo-5,5-bi[7H-furo[3,2-g][1]benzopyran]-7,7-dione

C22H12O6 (372.0633852)


   

3beta-chloro-8alpha-acetoxy-4alpha,10alpha-dihydroxy-1alpha,2alpha-epoxy-5alpha,7alphaH-guai-11(13)-en-12,6alpha-olide

3beta-chloro-8alpha-acetoxy-4alpha,10alpha-dihydroxy-1alpha,2alpha-epoxy-5alpha,7alphaH-guai-11(13)-en-12,6alpha-olide

C17H21ClO7 (372.09757460000003)


   

4,5-[Oxy(3,6-dimethyl-5-methoxy-1,2-phenylene)carbonyloxy]-6-methyl-3,7-dihydroxyisobenzofuran-1(3H)-one

4,5-[Oxy(3,6-dimethyl-5-methoxy-1,2-phenylene)carbonyloxy]-6-methyl-3,7-dihydroxyisobenzofuran-1(3H)-one

C19H16O8 (372.0845136)


   

cryptostictinolide

cryptostictinolide

C19H16O8 (372.0845136)


   
   
   

9,10-dihydro-6-hydroxy-5,7,8-trimethoxy-9,10-dioxoanthracen-2-yl acetate

9,10-dihydro-6-hydroxy-5,7,8-trimethoxy-9,10-dioxoanthracen-2-yl acetate

C19H16O8 (372.0845136)


   

1,6-diacetoxy-2,8-dimethoxy-xanthen-9-one|3,8-Diacetoxy-1,7-dimethoxyxanthon (Isogentiacanlein)

1,6-diacetoxy-2,8-dimethoxy-xanthen-9-one|3,8-Diacetoxy-1,7-dimethoxyxanthon (Isogentiacanlein)

C19H16O8 (372.0845136)


   
   
   
   

2alpha,5,7-trihydroxy-3beta-methylchromanone-2-O-beta-D-glucoside|takanechromanone A

2alpha,5,7-trihydroxy-3beta-methylchromanone-2-O-beta-D-glucoside|takanechromanone A

C16H20O10 (372.105642)


   
   

8-Butyryl-1,4,5,7-tetrahydroxy-2-methoxy-anthrachinon|8-Hydroxy,7-Me ether-Rhodocomatulin-8-Hydroxy,7-Me ether|rubrocomatulin 6-methyl ether

8-Butyryl-1,4,5,7-tetrahydroxy-2-methoxy-anthrachinon|8-Hydroxy,7-Me ether-Rhodocomatulin-8-Hydroxy,7-Me ether|rubrocomatulin 6-methyl ether

C19H16O8 (372.0845136)


   

7-caffeoylsedoheptulose

7-caffeoylsedoheptulose

C16H20O10 (372.105642)


   

(1)Benzopyrano(5,4,3-cde)(1,3)dioxolo(4,5-h)(1)benzopyran-5,11-dione, 1,2,3-trimethoxy-

(1)Benzopyrano(5,4,3-cde)(1,3)dioxolo(4,5-h)(1)benzopyran-5,11-dione, 1,2,3-trimethoxy-

C18H12O9 (372.0481302)


   

2(Z)-O-feruloylgluconic acid

2(Z)-O-feruloylgluconic acid

C16H20O10 (372.105642)


   

3,8-dihydroxy-4,7-dimethoxy-1-methylanthraquinone-2-carboxylic acid methyl ester

3,8-dihydroxy-4,7-dimethoxy-1-methylanthraquinone-2-carboxylic acid methyl ester

C19H16O8 (372.0845136)


   

shimobashiric acid A

shimobashiric acid A

C19H16O8 (372.0845136)


   

5-hydroxy-3,6,8-trimethoxy-3,4-methylenedioxyflavone

5-hydroxy-3,6,8-trimethoxy-3,4-methylenedioxyflavone

C19H16O8 (372.0845136)


   

rubiflavinone C-1

rubiflavinone C-1

C23H16O5 (372.0997686)


   

8-epiblechnic acid

8-epiblechnic acid

C19H16O8 (372.0845136)


   

glycoflavanones A

glycoflavanones A

C19H16O8 (372.0845136)


   
   

2,3-dicarboxy-6,7-dihydroxy-1-(3,4-dihydroxy)-phenyl-1,2-dihydronaphthalene-10-methyl ester

2,3-dicarboxy-6,7-dihydroxy-1-(3,4-dihydroxy)-phenyl-1,2-dihydronaphthalene-10-methyl ester

C19H16O8 (372.0845136)


   
   

4-acetoxy-6-(3,4-diacetoxy-styryl)-pyran-2-one|Tri-O-acetyl-hispidin

4-acetoxy-6-(3,4-diacetoxy-styryl)-pyran-2-one|Tri-O-acetyl-hispidin

C19H16O8 (372.0845136)


   

8-acetoxyaflatoxins B2

8-acetoxyaflatoxins B2

C19H16O8 (372.0845136)


   

5-hydroxyisopsorofebrin|O-De-Me,11-O-Me,1-hydroxy-2,3,3a,12c-Tetrahydro-3,11-dihydroxy-6-methoxy-3-methyl-7H-furo[2,3:4,5]furo[2,3-c]xanthen-7-one,

5-hydroxyisopsorofebrin|O-De-Me,11-O-Me,1-hydroxy-2,3,3a,12c-Tetrahydro-3,11-dihydroxy-6-methoxy-3-methyl-7H-furo[2,3:4,5]furo[2,3-c]xanthen-7-one,

C19H16O8 (372.0845136)


   

1-O-[(E)-5-hydroxyferuloyl]-beta-glucopyranose

1-O-[(E)-5-hydroxyferuloyl]-beta-glucopyranose

C16H20O10 (372.105642)


   

(7bbeta,12balpha,14calpha)-1,3,5-trihydroxy-7b,12b,13,14c-tetrahydro-14H-benzo[c]naphtho[2,1,8-mna]xanthen-14-one|ohioensin H

(7bbeta,12balpha,14calpha)-1,3,5-trihydroxy-7b,12b,13,14c-tetrahydro-14H-benzo[c]naphtho[2,1,8-mna]xanthen-14-one|ohioensin H

C23H16O5 (372.0997686)


   
   

3alpha-chloro-9alpha-acetoxy-4beta,10alpha-dihydroxy-1beta,2beta-epoxy-5alpha,7alphaH-guai-11(13)en-12,6alpha-olide

3alpha-chloro-9alpha-acetoxy-4beta,10alpha-dihydroxy-1beta,2beta-epoxy-5alpha,7alphaH-guai-11(13)en-12,6alpha-olide

C17H21ClO7 (372.09757460000003)


   
   

Eckol

Dibenzo(b,e)(1,4)-dioxin-1,3,6,8-tetrol, 4-(3,5-dihydroxyphenoxy)-

C18H12O9 (372.0481302)


Eckol is a phlorotannin that is oxanthrene-1,3,6,8-tetrol substituted by a 3,5-dihydroxyphenoxy moiety at position 4. Isolated from the marine brown alga, Ecklonia cava, it exhibits antioxidant activity. It has a role as a metabolite and an antioxidant. It is functionally related to a phloroglucinol. Eckol is a natural product found in Ecklonia cava, Ecklonia maxima, and Eisenia bicyclis with data available. A phlorotannin that is oxanthrene-1,3,6,8-tetrol substituted by a 3,5-dihydroxyphenoxy moiety at position 4. Isolated from the marine brown alga, Ecklonia cava, it exhibits antioxidant activity.

   

Hydroxypioglitazone

Hydroxy Pioglitazone

C19H20N2O4S (372.11437200000006)


A member of the class of thiazolidenediones that is the hydroxy derivative of pioglitazone. C78272 - Agent Affecting Nervous System

   

alpha1-Rhodomycinone

alpha1-Rhodomycinone

C19H16O8 (372.0845136)


   

9-Hydroxy-7-(3,4,5-trimethoxyphenyl)-8H-1,3-dioxolo[4,5-g][1]benzopyran-8-one

9-Hydroxy-7-(3,4,5-trimethoxyphenyl)-8H-1,3-dioxolo[4,5-g][1]benzopyran-8-one

C19H16O8 (372.0845136)


   
   
   

4-hydroxy-austrocorticinic acid|4-Hydroxyaustrocorticinic acid

4-hydroxy-austrocorticinic acid|4-Hydroxyaustrocorticinic acid

C19H16O8 (372.0845136)


   
   
   

5,6,7,8-tetrahydroxycoumarin-5-beta-glucopyranoside

5,6,7,8-tetrahydroxycoumarin-5-beta-glucopyranoside

C15H16O11 (372.0692586)


   
   

4,6-Diformyl-3,8-dihydroxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|4,6-diformyl-3,8-dihydroxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

4,6-Diformyl-3,8-dihydroxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|4,6-diformyl-3,8-dihydroxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

C18H12O9 (372.0481302)


   
   

3,5-O-Cyclodiospyrin

3,5-O-Cyclodiospyrin

C22H12O6 (372.0633852)


   

(3AR,4R,5R,6AS)-5-HYDROXY-4-((R,E)-3-HYDROXY-4-(3-(TRIFLUOROMETHYL)-PHENOXY)BUT-1-EN-1-YL)HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-2-ONE

(3AR,4R,5R,6AS)-5-HYDROXY-4-((R,E)-3-HYDROXY-4-(3-(TRIFLUOROMETHYL)-PHENOXY)BUT-1-EN-1-YL)HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-2-ONE

C18H19F3O5 (372.118452)


   

Norstictic_acid

5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde

C18H12O9 (372.0481302)


D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates Norstictic acid is a natural product found in Buellia, Dimelaena, and other organisms with data available.

   

3,4,5-Tmmf

12,13,14-trimethoxy-3,5,10,17-tetraoxapentacyclo[9.6.2.02,6.08,18.015,19]nonadeca-1(18),2(6),7,11,13,15(19)-hexaene-9,16-dione

C18H12O9 (372.0481302)


(1)Benzopyrano(5,4,3-cde)(1,3)dioxolo(4,5-h)(1)benzopyran-5,11-dione, 1,2,3-trimethoxy- is a natural product found in Camptotheca acuminata and Miconia affinis with data available.

   
   

C16H20O10_3-(Benzoyloxy)-2-hydroxypropyl beta-D-glucopyranosiduronic acid

NCGC00384897-01_C16H20O10_3-(Benzoyloxy)-2-hydroxypropyl beta-D-glucopyranosiduronic acid

C16H20O10 (372.105642)


   

(4R,8S)-17-chloro-2,18-dimethoxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1(12),2,5,10,14,16,18-heptaen-20-one

(4R,8S)-17-chloro-2,18-dimethoxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1(12),2,5,10,14,16,18-heptaen-20-one

C19H13ClO6 (372.04006280000004)


   

Penicillin G potassium

Penicillin g potassium salt

C16H17KN2O4S (372.0546062000001)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic

   

[IIN-based on: CCMSLIB00000848040]

NCGC00380638-01! [IIN-based on: CCMSLIB00000848040]

C19H13ClO6 (372.04006280000004)


   

[IIN-based: Match]

NCGC00380638-01! [IIN-based: Match]

C19H13ClO6 (372.04006280000004)


   

(2S,3S,4S,5R,6R)-6-(3-benzoyloxy-2-hydroxypropoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid_major

(2S,3S,4S,5R,6R)-6-(3-benzoyloxy-2-hydroxypropoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid_major

C16H20O10 (372.105642)


   

Norstictic Acid_85.5\\%

Norstictic Acid_85.5\\%

C18H12O9 (372.0481302)


   

(4R,8S)-17-chloro-2,18-dimethoxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹?.0?,?.0¹?,¹?]icosa-1(12),2,5,10,14,16,18-heptaen-20-one

(4R,8S)-17-chloro-2,18-dimethoxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹?.0?,?.0¹?,¹?]icosa-1(12),2,5,10,14,16,18-heptaen-20-one

C19H13ClO6 (372.04006280000004)


   
   
   

Repenone

6a,12a-Dehydro-9,10,11-trihydroxy-6-acetoxyrotenone

C18H12O9 (372.0481302)


   

Herbacetin 8-butyrate

Herbacetin 8-butyrate

C19H16O8 (372.0845136)


   

Fluprostenol Lactone Diol

(+)-(3aR,4R,5R,6aS)-hexahydro-5-hydroxy-4-[(1E,3R)-3-hydroxy-4-(3-trifluoromethyl)phenoxy-1-butenyl]-2H-cyclopenta[b]furan-2-one

C18H19F3O5 (372.118452)


   

Met-Asp-OH

(S)-2-(3-(2-(methylthio)ethoxy)-4-nitrobenzamido)pentanedioic acid

C14H16N2O8S (372.0627336)


   

Asp-Met-OH

(S)-2-(3-(carboxymethoxy)-4-nitrobenzamido)-5-(methylthio)pentanoic acid

C14H16N2O8S (372.0627336)


   

Veranisatin C

methyl 4,5,7,11-tetrahydroxy-2-methyl-2,10-dioxo-9-oxaspiro[oxetane-3,6-tricyclo[6.3.1.0^{1,5}]dodecane]-7-carboxylate

C16H20O10 (372.105642)


   

Gomphidic acid

2-[(2Z)-3-hydroxy-5-oxo-4-(3,4,5-trihydroxyphenyl)-2,5-dihydrofuran-2-ylidene]-2-(4-hydroxyphenyl)acetic acid

C18H12O9 (372.0481302)


   

Dihydroferulic acid 4-O-glucuronide

(2S,3S,4S,5R,6S)-6-[4-(2-carboxyethyl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C16H20O10 (372.105642)


   

3-(Benzoyloxy)-2-hydroxypropyl ?-D-glucopyranosiduronic acid

3-(Benzoyloxy)-2-hydroxypropyl ?-D-glucopyranosiduronic acid

C16H20O10 (372.105642)


   

11,12-epoxy-17-bromo-8S-hydroxy-9E-heptadecen-16-ynoic acid

11,12-epoxy-17-bromo-8S-hydroxy-9E-heptadecen-16-ynoic acid

C17H25O4Br (372.093611)


   

tributyl(1,2,2-trifluoroethenyl)stannane

tributyl(1,2,2-trifluoroethenyl)stannane

C14H27F3Sn (372.10867279999997)


   

(2R)-2-Deoxy-2-fluoro-2-methyl-D-erythropentonic acid gamma-lactone 3,5-dibenzoate

(2R)-2-Deoxy-2-fluoro-2-methyl-D-erythropentonic acid gamma-lactone 3,5-dibenzoate

C20H17FO6 (372.1009114)


   

Oxametacin

Oxametacin

C19H17ClN2O4 (372.0876792)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   
   

3,5-dihydroxy-4-phenylisoxazole hemihydrate

3,5-dihydroxy-4-phenylisoxazole hemihydrate

C18H16N2O7 (372.0957466)


   
   

3,6-bis[4-(trifluoromethyl)phenyl]-1,4-dihydro-1,2,4,5-tetrazine

3,6-bis[4-(trifluoromethyl)phenyl]-1,4-dihydro-1,2,4,5-tetrazine

C16H10F6N4 (372.0809612)


   

3-phenyl-5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-1,2,4-oxadiazole

3-phenyl-5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-1,2,4-oxadiazole

C19H11F3N2OS (372.0544152)


   
   

5-bromo-1-(4-fluorophenyl)-3-piperidin-4-ylindole

5-bromo-1-(4-fluorophenyl)-3-piperidin-4-ylindole

C19H18BrFN2 (372.06372999999996)


   

Premarin

Estrone sulfate sodium

C18H21NaO5S (372.10073360000007)


C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones Estrone sulfate, a biologically inactive form of estrogen, is a major circulating plasma estrogen that is converted into the biologically active estrogen, estrone (E1) by steroid sulfatase (STS). Estrone sulfate can be used for the research of breast cancer[1][2].

   
   

7-HYDROXY-3-(1-PHENYL-1H-PYRAZOL-4-YL)-2-TRIFLUOROMETHYL-CHROMEN-4-ONE

7-HYDROXY-3-(1-PHENYL-1H-PYRAZOL-4-YL)-2-TRIFLUOROMETHYL-CHROMEN-4-ONE

C19H11F3N2O3 (372.07217319999995)


   

1-[(4-chlorophenyl)-phenylmethyl]-4-methylpiperazine,dihydrochloride

1-[(4-chlorophenyl)-phenylmethyl]-4-methylpiperazine,dihydrochloride

C18H23Cl3N2 (372.0926728)


   

6-[[2,8-bis(trifluoromethyl)quinolin-4-yl]methyl]pyridin-3-ol

6-[[2,8-bis(trifluoromethyl)quinolin-4-yl]methyl]pyridin-3-ol

C17H10F6N2O (372.0697282)


   

2-(2-(2-FLUOROPHENYL)-5-HYDROXY-8-METHYL-7-OXO-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXAMIDO)ACETIC ACID

2-(2-(2-FLUOROPHENYL)-5-HYDROXY-8-METHYL-7-OXO-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXAMIDO)ACETIC ACID

C17H13FN4O5 (372.086994)


   

4-(1H,1H,2H,2H-PERFLUOROHEXYL-1-THIO)-PHENOL

4-(1H,1H,2H,2H-PERFLUOROHEXYL-1-THIO)-PHENOL

C12H9F9OS (372.0230372)


   

quizalofop-P-ethyl

quizalofop-P-ethyl

C19H17ClN2O4 (372.0876792)


D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

4-(TERT-BUTYL)-2,6-DIMETHYL-3,5-DINITROPHENACYL BROMIDE

4-(TERT-BUTYL)-2,6-DIMETHYL-3,5-DINITROPHENACYL BROMIDE

C14H17BrN2O5 (372.0320772)


   

tert-Butyl 4-(2-bromo-4-fluorobenzyl)piperazine-1-carboxylate

tert-Butyl 4-(2-bromo-4-fluorobenzyl)piperazine-1-carboxylate

C16H22BrFN2O2 (372.0848584)


   

2-Bromo-13,13-dimethyl-13H-indeno[1,2-b]anthracene

2-Bromo-13,13-dimethyl-13H-indeno[1,2-b]anthracene

C23H17Br (372.0513542)


   

2-(4-BOC-Piperazinomethyl)-1-bromo-3-fluorobenzene

2-(4-BOC-Piperazinomethyl)-1-bromo-3-fluorobenzene

C16H22BrFN2O2 (372.0848584)


   

Exisulind

Sulindac sulfone

C20H17FO4S (372.0831534)


D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor > C2127 - cGMP Phosphodiesterase Inhibitor D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D020011 - Protective Agents > D016588 - Anticarcinogenic Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors

   
   

2-[2-(Boc-L-alanyl)aminothaizol-4-yl]-2-methoxyimino acetic acid

2-[2-(Boc-L-alanyl)aminothaizol-4-yl]-2-methoxyimino acetic acid

C14H20N4O6S (372.11035000000004)


   

3-Aminobenzeneboronic acid hemisulfate salt

3-Aminobenzeneboronic acid hemisulfate salt

C12H18B2N2O8S (372.0969928)


   

17β-Dihydro Equilin 3-Sulfate Sodium Salt

17β-Dihydro Equilin 3-Sulfate Sodium Salt

C18H21NaO5S (372.10073360000007)


   

methyl(S)-1-((S)-2-(5-bromo-1H-imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamate

methyl(S)-1-((S)-2-(5-bromo-1H-imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamate

C14H21BrN4O3 (372.07969360000004)


   

4,5-Dioxo-4,5-dihydro-1H-pyrrol[2,3-f]quinoline-2,7,9-tricarboxylic acid trimethyl ester

4,5-Dioxo-4,5-dihydro-1H-pyrrol[2,3-f]quinoline-2,7,9-tricarboxylic acid trimethyl ester

C17H12N2O8 (372.0593632)


   

8-(4-fluorophenyl)-2-methyl-4,7-dioxo-5-phenyl-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile

8-(4-fluorophenyl)-2-methyl-4,7-dioxo-5-phenyl-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile

C21H13FN4O2 (372.102249)


   
   
   

4-Bromo-2-(4-BOC-piperazinomethyl)-1-fluorobenzene

4-Bromo-2-(4-BOC-piperazinomethyl)-1-fluorobenzene

C16H22BrFN2O2 (372.0848584)


   
   

2(3H)-Benzothiazolone, 3-((4-(2-methyl-1H-imidazo(4,5-C)pyridin-1-yl)phenyl)methyl)-

2(3H)-Benzothiazolone, 3-((4-(2-methyl-1H-imidazo(4,5-C)pyridin-1-yl)phenyl)methyl)-

C21H16N4OS (372.1044766)


   

2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-YL) ethyl-4-(4-ethoxy [1,1-biphenyl]-4-YL)-4-oxobutanoic acid

2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-YL) ethyl-4-(4-ethoxy [1,1-biphenyl]-4-YL)-4-oxobutanoic acid

C19H20N2O4S (372.11437200000006)


   

Hexadimethrini bromidum

Hexadimethrini bromidum

C13H30Br2N2 (372.077558)


D006401 - Hematologic Agents > D003029 - Coagulants > D006494 - Heparin Antagonists D001697 - Biomedical and Dental Materials

   

1,3-Benzothiazol-2-yl(2-((2-(3-pyridinyl)ethyl)amino)-4-pyrimidinyl)acetonitrile

1,3-Benzothiazol-2-yl(2-((2-(3-pyridinyl)ethyl)amino)-4-pyrimidinyl)acetonitrile

C20H16N6S (372.1157096)


   

6-[(3-Aminophenyl)methyl]-4,6-dihydro-4-methyl-2-(methylsulfinyl)-5h-thieno[2,3:4,5]pyrrolo[2,3-d]pyridazin-5-one

6-[(3-Aminophenyl)methyl]-4,6-dihydro-4-methyl-2-(methylsulfinyl)-5h-thieno[2,3:4,5]pyrrolo[2,3-d]pyridazin-5-one

C17H16N4O2S2 (372.07146359999996)


   

(2Z,5Z)-5-(4-hydroxy-3,5-dimethoxybenzylidene)-2-((4-hydroxyphenyl)imino)thiazolidin-4-one

(2Z,5Z)-5-(4-hydroxy-3,5-dimethoxybenzylidene)-2-((4-hydroxyphenyl)imino)thiazolidin-4-one

C18H16N2O5S (372.0779886)


   

2-(Benzenesulfonylmethyl)-5-(4-methoxyphenyl)cyclohexane-1,3-dione

2-(Benzenesulfonylmethyl)-5-(4-methoxyphenyl)cyclohexane-1,3-dione

C20H20O5S (372.10313900000006)


   

ethyl (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate

ethyl (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate

C19H17ClN2O4 (372.0876792)


   
   

[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-methylbenzenesulfonate

[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-methylbenzenesulfonate

C18H16N2O5S (372.0779886)


   

4-[4-Amino-6-(2,6-dichloro-phenoxy)-[1,3,5]triazin-2-ylamino]-benzonitrile

4-[4-Amino-6-(2,6-dichloro-phenoxy)-[1,3,5]triazin-2-ylamino]-benzonitrile

C16H10Cl2N6O (372.029311)


   

Methyl-2-S-(alpha-D-mannopyranosyl)-2-thio-alpha-D-mannopyranoside

Methyl-2-S-(alpha-D-mannopyranosyl)-2-thio-alpha-D-mannopyranoside

C13H24O10S (372.1090124)


   

(Z)-3-Benzyl-5-(2-Hydroxy-3-Nitrobenzylidene)-2-Thioxothiazolidin-4-One

(Z)-3-Benzyl-5-(2-Hydroxy-3-Nitrobenzylidene)-2-Thioxothiazolidin-4-One

C17H12N2O4S2 (372.0238472)


   

(2s)-1,3-Benzothiazol-2-Yl{2-[(2-Pyridin-3-Ylethyl)amino]pyrimidin-4-Yl}ethanenitrile

(2s)-1,3-Benzothiazol-2-Yl{2-[(2-Pyridin-3-Ylethyl)amino]pyrimidin-4-Yl}ethanenitrile

C20H16N6S (372.1157096)


   

3-[1-(4-Bromo-phenyl)-2-methyl-propyl]-4-hydroxy-chromen-2-one

3-[1-(4-Bromo-phenyl)-2-methyl-propyl]-4-hydroxy-chromen-2-one

C19H17BrO3 (372.03609919999997)


   

Edetate disodium

Disodium edetate dihydrate

C10H18N2Na2O10 (372.0756808)


D064449 - Sequestering Agents > D002614 - Chelating Agents > D065096 - Calcium Chelating Agents D000074385 - Food Ingredients > D005503 - Food Additives D006401 - Hematologic Agents > D000925 - Anticoagulants

   
   

deacetylcephalosporin C(1-)

deacetylcephalosporin C(1-)

C14H18N3O7S- (372.0865418)


A cephalosporin carboxylic acid anion that is the conjugate base of deacetylcephalosporin C, arising from deprotonation of both carboxy groups and protonation of the amino group; major species at pH 7.3.

   

Violaceinate

Violaceinate

C21H14N3O4- (372.09842640000005)


A monocarboxylic acid anion that is the conjugate base of violaceinic acid, resulting from the removal of the proton from the carboxy group. Major structure at pH 7.3.

   

hydrodidemethylasterriquinone D

hydrodidemethylasterriquinone D

C22H16N2O4-2 (372.1110016)


   
   

5-Methoxy-6-methylbenzimidazole ribotide phosphate

5-Methoxy-6-methylbenzimidazole ribotide phosphate

C14H17N2O8P-2 (372.07224920000004)


   

2-Hydroxy-5-[(6-sulfonaphthalen-2-yl)diazenyl]benzoic acid

2-Hydroxy-5-[(6-sulfonaphthalen-2-yl)diazenyl]benzoic acid

C17H12N2O6S (372.04160520000005)


   

[(2R,3S,4R,5S)-5-(5-cyano-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

[(2R,3S,4R,5S)-5-(5-cyano-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

C12H13N4O8P (372.0470988)


   

(5Z)-5-[(2-Benzyl-5-hydroxy-4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-5-[(2-Benzyl-5-hydroxy-4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

C17H12N2O4S2 (372.0238472)


   

[(Z)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylpent-4-enylideneamino] sulfate

[(Z)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylpent-4-enylideneamino] sulfate

C11H18NO9S2- (372.0422958)


   

1-S-[(1Z)-N-(sulfonatooxy)pent-4-enimidoyl]-1-thio-beta-D-glucopyranose

1-S-[(1Z)-N-(sulfonatooxy)pent-4-enimidoyl]-1-thio-beta-D-glucopyranose

C11H18NO9S2- (372.0422958)


   

N1-{3-[2-(2-pyridyl)ethyl]phenyl}-4-chlorobenzene-1-sulfonamide

N1-{3-[2-(2-pyridyl)ethyl]phenyl}-4-chlorobenzene-1-sulfonamide

C19H17ClN2O2S (372.0699212)


   

4-(4-(4-Chlorobenzyl)piperazin-1-yl)-6-ethylthieno[2,3-d]pyrimidine

4-(4-(4-Chlorobenzyl)piperazin-1-yl)-6-ethylthieno[2,3-d]pyrimidine

C19H21ClN4S (372.11753760000005)


   

5-[(4-chloro-1-pyrazolyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-furancarboxamide

5-[(4-chloro-1-pyrazolyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-furancarboxamide

C17H13ClN4O2S (372.04477080000004)


   

3-chloro-5-(2-furanyl)-N-propan-2-yl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide

3-chloro-5-(2-furanyl)-N-propan-2-yl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide

C15H12ClF3N4O2 (372.0600838)


   

N-(4-methyl-1,3-benzothiazol-2-yl)-9H-xanthene-9-carboxamide

N-(4-methyl-1,3-benzothiazol-2-yl)-9H-xanthene-9-carboxamide

C22H16N2O2S (372.0932436)


   

2-(6-Imidazo[2,1-b]thiazolyl)acetic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester

2-(6-Imidazo[2,1-b]thiazolyl)acetic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester

C16H12N4O3S2 (372.0350802)


   

(2-Morpholin-4-yl-2-oxoethyl) 4-methylsulfonyl-3-nitrobenzoate

(2-Morpholin-4-yl-2-oxoethyl) 4-methylsulfonyl-3-nitrobenzoate

C14H16N2O8S (372.0627336)


   

Disodium edta dihydrate

Disodium edetate dihydrate

C10H18N2Na2O10 (372.0756808)


   

N-{(E)-[5-(3-bromophenyl)furan-2-yl]methylidene}-3-methyl-1H-pyrazole-5-carbohydrazide

N-{(E)-[5-(3-bromophenyl)furan-2-yl]methylidene}-3-methyl-1H-pyrazole-5-carbohydrazide

C16H13BrN4O2 (372.0221818)


   

1-[[1-[(4-Chlorophenyl)methyl]-2-oxo-3-indolylidene]amino]-3-ethylthiourea

1-[[1-[(4-Chlorophenyl)methyl]-2-oxo-3-indolylidene]amino]-3-ethylthiourea

C18H17ClN4OS (372.0811542)


   

N-[(E)-(6-chloro-4-oxo-4H-chromen-3-yl)methylidene]-4-hydroxy-3-methoxybenzohydrazide

N-[(E)-(6-chloro-4-oxo-4H-chromen-3-yl)methylidene]-4-hydroxy-3-methoxybenzohydrazide

C18H13ClN2O5 (372.05129580000005)


   

N-[4-[methyl(phenyl)sulfamoyl]phenyl]-2-thiophenecarboxamide

N-[4-[methyl(phenyl)sulfamoyl]phenyl]-2-thiophenecarboxamide

C18H16N2O3S2 (372.0602306)


   

N-[2,5-dimethoxy-4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-2-furancarboxamide

N-[2,5-dimethoxy-4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-2-furancarboxamide

C18H16N2O5S (372.0779886)


   

N-[2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-1-oxoethyl]-2-(4-methylphenoxy)acetohydrazide

N-[2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-1-oxoethyl]-2-(4-methylphenoxy)acetohydrazide

C16H16N6O3S (372.10045460000003)


   
   

N-(4-hydroxyphenyl)-N-methyl-N-thiophen-2-ylsulfonylbenzenecarboximidamide

N-(4-hydroxyphenyl)-N-methyl-N-thiophen-2-ylsulfonylbenzenecarboximidamide

C18H16N2O3S2 (372.0602306)


   

(17S)-5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde

(17S)-5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde

C18H12O9 (372.0481302)


   

N-ethyl-2-[(2S,3S,6R)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

N-ethyl-2-[(2S,3S,6R)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

C16H21FN2O5S (372.1155148)


   

N-ethyl-2-[(2S,3S,6S)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

N-ethyl-2-[(2S,3S,6S)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

C16H21FN2O5S (372.1155148)


   

N-ethyl-2-[(2R,3R,6S)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

N-ethyl-2-[(2R,3R,6S)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

C16H21FN2O5S (372.1155148)


   

N-ethyl-2-[(2R,3R,6R)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

N-ethyl-2-[(2R,3R,6R)-3-[(4-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetamide

C16H21FN2O5S (372.1155148)


   

Thiamine hydrochloride dihydrate

Thiamine hydrochloride dihydrate

C12H22Cl2N4O3S (372.0789602)


   

2-{[(2E)-3-iodoprop-2-en-1-yl](propyl)ammonio}tetralin-7-ol(1+)

2-{[(2E)-3-iodoprop-2-en-1-yl](propyl)ammonio}tetralin-7-ol(1+)

C16H23INO+ (372.0824318)


   
   

[2-Hydroxy-5-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen sulate

[2-Hydroxy-5-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen sulate

C15H16O9S (372.05150060000005)


   

3,4,5-trihydroxy-6-[(E)-3-(2,4,5-trihydroxyphenyl)prop-2-enoyl]oxyoxane-2-carboxylic acid

3,4,5-trihydroxy-6-[(E)-3-(2,4,5-trihydroxyphenyl)prop-2-enoyl]oxyoxane-2-carboxylic acid

C15H16O11 (372.0692586)


   

(2R,3S,4R,5S)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2,3,4,5-tetrahydroxyhexanedioic acid

(2R,3S,4R,5S)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2,3,4,5-tetrahydroxyhexanedioic acid

C15H16O11 (372.0692586)


   

3,4,5-Trihydroxy-6-[3-(4-hydroxy-3-methoxyphenyl)propanoyloxy]oxane-2-carboxylic acid

3,4,5-Trihydroxy-6-[3-(4-hydroxy-3-methoxyphenyl)propanoyloxy]oxane-2-carboxylic acid

C16H20O10 (372.105642)


   

3,4,5-Trihydroxy-6-[3-(3-hydroxy-5-methoxyphenyl)propanoyloxy]oxane-2-carboxylic acid

3,4,5-Trihydroxy-6-[3-(3-hydroxy-5-methoxyphenyl)propanoyloxy]oxane-2-carboxylic acid

C16H20O10 (372.105642)


   

2-[(3E)-6-fluoro-2-(hydroxymethyl)-3-[[4-[(S)-methylsulfinyl]phenyl]methylidene]inden-1-yl]acetic acid

2-[(3E)-6-fluoro-2-(hydroxymethyl)-3-[[4-[(S)-methylsulfinyl]phenyl]methylidene]inden-1-yl]acetic acid

C20H17FO4S (372.0831534)


   

[5-[2-amino-5-(azaniumylmethyl)-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl]-3-hydroxy-2,5-dihydrofuran-2-yl]methyl phosphate

[5-[2-amino-5-(azaniumylmethyl)-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl]-3-hydroxy-2,5-dihydrofuran-2-yl]methyl phosphate

C12H15N5O7P- (372.07090700000003)


   

QUIZALOFOP-ETHYL

QUIZALOFOP-ETHYL

C19H17ClN2O4 (372.0876792)


D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

4-(N-Maleimido)benzyltrimethylammonium iodide

4-(N-Maleimido)benzyltrimethylammonium iodide

C14H17IN2O2 (372.0334732)


   

2-O-caffeoylglucaric acid

2-O-caffeoylglucaric acid

C15H16O11 (372.0692586)


   

(2S,3S,4S,5R,6S)-6-[5-(2-carboxyethyl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

(2S,3S,4S,5R,6S)-6-[5-(2-carboxyethyl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C16H20O10 (372.105642)


   

Impatienol(2-)

Impatienol(2-)

C22H12O6 (372.0633852)


An enolate anion that is the dianion obtained by the deprotonation of the enol groups of impatienol.

   

Gluconapin(1-)

Gluconapin(1-)

C11H18NO9S2 (372.0422958)


An alkenylglucosinolate that is the conjugate base of gluconapin.

   

N-Maleimidobenzyltrimethylammonium iodide

N-Maleimidobenzyltrimethylammonium iodide

C14H17IN2O2 (372.0334732)


   

H4R antagonist 3

H4R antagonist 3

C19H21ClN4S (372.11753760000005)


H4R antagonist 3 (Example 18) is a histamine-4 receptor antagonist with an EC50 of <10 mM. H4R antagonist 3 can be used for the research of prevention of inflammatory, autoimmune, allergic, and ocular diseases[1].

   

Kras4B G12D-IN-1

Kras4B G12D-IN-1

C16H21ClN2O4S (372.0910496000001)


Kras4B G12D-IN-1 is a Kras4B G12D inhibitor with anticancer effects. Kras4B G12D-IN-1 decreases Kras protein expression in mouse embryonic fibroblasts (MEF) expressing Kras4B G12D (WO2016179558A1, Comp 994566)[1].

   

(1r,15s,23s)-6,9,11-trihydroxy-22-oxahexacyclo[10.10.2.0²,⁷.0⁸,²⁴.0¹⁵,²³.0¹⁶,²¹]tetracosa-2,4,6,8,10,12(24),16,18,20-nonaen-13-one

(1r,15s,23s)-6,9,11-trihydroxy-22-oxahexacyclo[10.10.2.0²,⁷.0⁸,²⁴.0¹⁵,²³.0¹⁶,²¹]tetracosa-2,4,6,8,10,12(24),16,18,20-nonaen-13-one

C23H16O5 (372.0997686)


   

(1r,2s,14s,15r)-8,12,17,21-tetraoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁵,⁹.0¹⁸,²⁶.0²⁰,²⁴]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione

(1r,2s,14s,15r)-8,12,17,21-tetraoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁵,⁹.0¹⁸,²⁶.0²⁰,²⁴]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione

C22H12O6 (372.0633852)


   

2-(2h-1,3-benzodioxol-5-yl)-7-hydroxy-3,5,8-trimethoxychromen-4-one

2-(2h-1,3-benzodioxol-5-yl)-7-hydroxy-3,5,8-trimethoxychromen-4-one

C19H16O8 (372.0845136)


   

(2r,3r,4r,5s)-2,3,4,5,7-pentahydroxy-6-oxoheptyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(2r,3r,4r,5s)-2,3,4,5,7-pentahydroxy-6-oxoheptyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C16H20O10 (372.105642)


   

1-hydroxy-16,17-dimethoxy-5,7,11,14-tetraoxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15,17,19-hexaen-21-one

1-hydroxy-16,17-dimethoxy-5,7,11,14-tetraoxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15,17,19-hexaen-21-one

C19H16O8 (372.0845136)


   

2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1,3(10),11,14,16,18-hexaene-13,20-dione

2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1,3(10),11,14,16,18-hexaene-13,20-dione

C18H12O9 (372.0481302)


   

12-chloro-2,11-dihydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,14-dioxatetracyclo[8.4.0.0¹,¹³.0⁵,⁹]tetradecan-3-yl acetate

12-chloro-2,11-dihydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,14-dioxatetracyclo[8.4.0.0¹,¹³.0⁵,⁹]tetradecan-3-yl acetate

C17H21ClO7 (372.09757460000003)


   

(2r)-7-hydroxy-2-[2-(4-hydroxyphenyl)-1-benzofuran-5-yl]-2,3-dihydro-1-benzopyran-4-one

(2r)-7-hydroxy-2-[2-(4-hydroxyphenyl)-1-benzofuran-5-yl]-2,3-dihydro-1-benzopyran-4-one

C23H16O5 (372.0997686)


   

(2s,3s)-5,7-dihydroxy-3-methyl-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one

(2s,3s)-5,7-dihydroxy-3-methyl-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one

C16H20O10 (372.105642)


   

1-methoxy-13h-6-oxapentacene-5,7,12,14-tetrone

1-methoxy-13h-6-oxapentacene-5,7,12,14-tetrone

C22H12O6 (372.0633852)


   

4,9,11-trihydroxy-22-oxahexacyclo[10.10.2.0²,⁷.0⁸,²⁴.0¹⁵,²³.0¹⁶,²¹]tetracosa-2,4,6,8,10,12(24),16,18,20-nonaen-13-one

4,9,11-trihydroxy-22-oxahexacyclo[10.10.2.0²,⁷.0⁸,²⁴.0¹⁵,²³.0¹⁶,²¹]tetracosa-2,4,6,8,10,12(24),16,18,20-nonaen-13-one

C23H16O5 (372.0997686)


   

methyl (1s,4ar,7ar)-7-oxo-1-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-4-carboxylate

methyl (1s,4ar,7ar)-7-oxo-1-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-4-carboxylate

C16H20O10 (372.105642)


   

(2s,3s)-3-(3,4-dihydroxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxooxolane-2-carboxylic acid

(2s,3s)-3-(3,4-dihydroxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxooxolane-2-carboxylic acid

C19H16O8 (372.0845136)


   

8,12,17,21-tetraoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁵,⁹.0¹⁸,²⁶.0²⁰,²⁴]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione

8,12,17,21-tetraoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁵,⁹.0¹⁸,²⁶.0²⁰,²⁴]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione

C22H12O6 (372.0633852)


   

quercetin 3'-isobutyrate

quercetin 3'-isobutyrate

C19H16O8 (372.0845136)


   

8-chloro-4,7,12-trihydroxy-3-methyl-3,4-dihydro-2h-tetracene-1,6,11-trione

8-chloro-4,7,12-trihydroxy-3-methyl-3,4-dihydro-2h-tetracene-1,6,11-trione

C19H13ClO6 (372.04006280000004)


   

(6s)-6,11-dihydroxy-2,3,9-trimethoxy-6h-5,7-dioxatetraphen-12-one

(6s)-6,11-dihydroxy-2,3,9-trimethoxy-6h-5,7-dioxatetraphen-12-one

C19H16O8 (372.0845136)


   

13,14-dihydroxy-15-methoxy-4-methyl-5,10,19-trioxapentacyclo[9.8.1.0¹,⁸.0³,⁷.0¹²,¹⁷]icosa-3,6,12(17),13,15-pentaene-2,9-dione

13,14-dihydroxy-15-methoxy-4-methyl-5,10,19-trioxapentacyclo[9.8.1.0¹,⁸.0³,⁷.0¹²,¹⁷]icosa-3,6,12(17),13,15-pentaene-2,9-dione

C19H16O8 (372.0845136)


   

[(4r)-4-[(1s,4s)-4-bromo-3,3-dimethylcyclohexyl]-2,3-dioxabicyclo[2.2.2]oct-5-en-1-yl]methyl acetate

[(4r)-4-[(1s,4s)-4-bromo-3,3-dimethylcyclohexyl]-2,3-dioxabicyclo[2.2.2]oct-5-en-1-yl]methyl acetate

C17H25BrO4 (372.093611)


   

(17r)-13,17-dihydroxy-5-methoxy-4,7,12-trimethyl-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-9,15-dione

(17r)-13,17-dihydroxy-5-methoxy-4,7,12-trimethyl-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-9,15-dione

C19H16O8 (372.0845136)


   

3-(2h-1,3-benzodioxol-5-yl)-4-hydroxy-5,6,7-trimethoxychromen-2-one

3-(2h-1,3-benzodioxol-5-yl)-4-hydroxy-5,6,7-trimethoxychromen-2-one

C19H16O8 (372.0845136)