Exact Mass: 356.07331220000003

Exact Mass Matches: 356.07331220000003

Found 394 metabolites which its exact mass value is equals to given mass value 356.07331220000003, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Gentiopicrin

(5R,6S)-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-vinyl-5,6-dihydropyrano[3,4-c]pyran-1(3H)-one

C16H20O9 (356.110727)


Gentiopicrin is a glycoside. Gentiopicroside is a natural product found in Aster auriculatus, Exacum affine, and other organisms with data available. See also: Centaurium erythraea whole (part of). Gentiopicroside. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=20831-76-9 (retrieved 2024-07-01) (CAS RN: 20831-76-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). Gentiopicroside, a naturally occurring iridoid glycoside, inhibits P450 activity, with an IC50 and a Ki of 61 μM and 22.8 μM for CYP2A6; Gentiopicroside has anti-inflammatoryand antioxidative effects. Gentiopicroside, a naturally occurring iridoid glycoside, inhibits P450 activity, with an IC50 and a Ki of 61 μM and 22.8 μM for CYP2A6; Gentiopicroside has anti-inflammatoryand antioxidative effects.

   

trans-p-Feruloyl-beta-D-glucopyranoside

(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 3-(4-hydroxy-3-methoxyphenyl)acrylate

C16H20O9 (356.110727)


Trans-p-feruloyl-beta-d-glucopyranoside, also known as 1-feruloyl-D-glucose, is a member of the class of compounds known as hydroxycinnamic acid glycosides. Hydroxycinnamic acid glycosides are glycosylated hydoxycinnamic acids derivatives. Trans-p-feruloyl-beta-d-glucopyranoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Trans-p-feruloyl-beta-d-glucopyranoside can be found in a number of food items such as green bell pepper, pepper (c. annuum), yellow bell pepper, and orange bell pepper, which makes trans-p-feruloyl-beta-d-glucopyranoside a potential biomarker for the consumption of these food products. 1-O-feruloyl-beta-D-glucose is a beta-D-glucoside resulting from the formal condensation of the carboxy group of ferulic acid with the anomeric hydroxy group of beta-D-glucose. It has a role as an antioxidant and a plant metabolite. It is a beta-D-glucoside, a cinnamate ester, a member of phenols and an aromatic ether. It is functionally related to a ferulic acid. 1-O-feruloyl-beta-D-glucose is a natural product found in Balanophora japonica, Linaria japonica, and other organisms with data available. Lavandoside is an active compound found from Lavandula spica flowers[1].

   

Pioglitazone

(+-)-5-((4-(2-(5-Ethyl-2-pyridinyl)ethoxy)phenyl)methyl)-2,4-thiazolidinedione

C19H20N2O3S (356.119457)


Pioglitazone is used for the treatment of diabetes mellitus type 2. Pioglitazone selectively stimulates nuclear receptor peroxisone proliferator-activated receptor gamma (PPAR-gamma). It modulates the transcription of the insulin-sensitive genes involved in the control of glucose and lipid metabolism in the lipidic, muscular tissues and in the liver. A - Alimentary tract and metabolism > A10 - Drugs used in diabetes > A10B - Blood glucose lowering drugs, excl. insulins > A10BG - Thiazolidinediones C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C98241 - Thiazolidinedione Antidiabetic Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D007004 - Hypoglycemic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Pioglitazone (U 72107) is an orally active and selective PPARγ (peroxisome proliferator-activated receptor) agonist with high affinity binding to the PPARγ ligand-binding domain with EC50 of 0.93 and 0.99 μM for human and mouse PPARγ, respectively. Pioglitazone can be used in diabetes research[2][3][4].

   

Sulindac

2-[(1Z)-5-fluoro-1-[(4-methanesulfinylphenyl)methylidene]-2-methyl-1H-inden-3-yl]acetic acid

C20H17FO3S (356.0882384)


Sulindac is a nonsteroidal anti-inflammatory agent (NSAIA) of the arylalkanoic acid class that is marketed in the U.S. by Merck as Clinoril. Like other NSAIAs, it may be used in the treatment of acute or chronic inflammatory conditions. Sulindac is a prodrug, derived from sulfinylindene, that is converted in vivo to an active sulfide compound by liver enzymes. The sulfide metabolite then undergoes enterohepatic circulation; it is excreted in the bile and then reabsorbed from the intestine. This is thought to help maintain constant blood levels with reduced gastrointestinal side effects. Some studies have shown sulindac to be relatively less irritating to the stomach than other NSAIAs except for drugs of the cyclooxygenase-2 (COX-2) inhibitor class. The exact mechanism of its NSAIA properties is unknown, but it is thought to act on enzymes COX-1 and COX-2, inhibiting prostaglandin synthesis. M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances 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 D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D000970 - Antineoplastic Agents KEIO_ID S054; [MS2] KO009077 KEIO_ID S054; [MS3] KO009079 D004791 - Enzyme Inhibitors KEIO_ID S054

   

5-Amino-6-(5'-phosphoribitylamino)uracil

{[(2R,3S,4S)-5-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-2,3,4-trihydroxypentyl]oxy}phosphonic acid

C9H17N4O9P (356.07331220000003)


5-Amino-6-(5-phosphoribitylamino)uracil belongs to the class of organic compounds known as monosaccharide phosphates. These are monosaccharides comprising a phosphated group linked to the carbohydrate unit. 5-Amino-6-(5-phosphoribitylamino)uracil is an extremely weak basic (essentially neutral) compound (based on its pKa). 5-Amino-6-(5-phosphoribitylamino)uracil has been detected, but not quantified in, several different foods, such as sapodilla, kumquats, sacred lotus, Persian limes, and Cascade huckleberries. This could make 5-amino-6-(5-phosphoribitylamino)uracil a potential biomarker for the consumption of these foods. 5-Amino-6-(5-phosphoribitylamino)uracil is an intermediate in riboflavin metabolism. 5-Amino-6-(5-phosphoribitylamino)uracil is the third to last step in the synthesis of 7-hydroxy-6-methyl-8-ribityl lumazine and is converted from 5-amino-6-(5-phosphoribosylamino)uracil via the enzyme 5-amino-6-(5-phosphoribosylamino)uracil reductase (EC 1.1.1.193). It is then converted into 4-(1-D-ribitylamino)-5-amino-2,6-dihydroxypyrimidine via a hydrolase enzyme (EC 3.1.3.- ). 5-amino-6-(5-phospho-d-ribitylamino)uracil is a member of the class of compounds known as monosaccharide phosphates. Monosaccharide phosphates are monosaccharides comprising a phosphated group linked to the carbohydrate unit. 5-amino-6-(5-phospho-d-ribitylamino)uracil is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 5-amino-6-(5-phospho-d-ribitylamino)uracil can be found in a number of food items such as star fruit, chinese cabbage, mamey sapote, and sapodilla, which makes 5-amino-6-(5-phospho-d-ribitylamino)uracil a potential biomarker for the consumption of these food products. 5-amino-6-(5-phospho-d-ribitylamino)uracil exists in E.coli (prokaryote) and yeast (eukaryote).

   
   
   

IAA-94

(S)-2-((6,7-Dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)acetic acid

C17H18Cl2O4 (356.05820880000005)


D018501 - Antirheumatic Agents > D006074 - Gout Suppressants > D014528 - Uricosuric Agents D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D045283 - Natriuretic Agents > D004232 - Diuretics

   

Methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-nitro-4-(2-(trifluoromethyl)phenyl)-, methyl ester

C16H15F3N2O4 (356.0983866)


D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents > D002120 - Calcium Channel Agonists D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators

   

Y 23684

(1)Benzothiepino(5,4-c)pyridazin-3(2H)-one, 2-(4-chlorophenyl)-5,6-dihydro-, 7-oxide

C18H13ClN2O2S (356.03862280000004)


   

Penicillin g sodium

Penicillin G Sodium Salt

C16H17N2NaO4S (356.08066820000005)


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

   

Ferulic acid 4-glucoside

(2E)-3-(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

C16H20O9 (356.110727)


Ferulic acid 4-glucoside is a member of the class of compounds known as phenolic glycosides. Phenolic glycosides are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Ferulic acid 4-glucoside is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Ferulic acid 4-glucoside can be found in a number of food items such as redcurrant, gooseberry, highbush blueberry, and blackcurrant, which makes ferulic acid 4-glucoside a potential biomarker for the consumption of these food products. (2E)-3-[4-(beta-D-glucopyranosyloxy)-3-methoxyphenyl]acrylic acid is a glycoside. (E)-4-Hydroxy-3-methoxycinnamic acid 4-O-|A-D-glucopyranoside is a natural product found in Ribes uva-crispa, Aristolochia kaempferi, and other organisms with data available. Lavandoside is an active compound found from Lavandula spica flowers[1].

   

1-O-Feruloylglucose

3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

C16H20O9 (356.110727)


1-O-Feruloylglucose is found in green vegetables. 1-O-Feruloylglucose is present in Solanum, Raphanus, etc. species.

   

4-O-alpha-D-Glucopyranuronosyl-D-galactose

3,4,5-trihydroxy-6-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-2-carboxylic acid

C12H20O12 (356.09547200000003)


4-O-alpha-D-Galactopyranuronosyl-D-galactose is a constituent of Sterculia urens (karaya gum). Constituent of Sterculia urens (karaya gum)

   

(+)-Chebulic acid

2-(3-carboxy-5,6,7-trihydroxy-1-oxo-3,4-dihydro-1H-2-benzopyran-4-yl)butanedioic acid

C14H12O11 (356.0379602)


(+)-Chebulic acid is found in fruits. (+)-Chebulic acid is isolated from Phyllanthus emblica (emblic). Isolated from Phyllanthus emblica (emblic). (+)-Chebulic acid is found in fruits.

   

2-O-beta-D-Glucopyranuronosyl-D-mannose

3,4,5-trihydroxy-6-{[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}oxane-2-carboxylic acid

C12H20O12 (356.09547200000003)


Present as a structural unit in plant gums, e.g. damson (Prunus insitia), cherry (Prunus cerasus), Anogeissus lattifolia (gum ghatti). 2-O-beta-D-Glucopyranuronosyl-D-mannose is found in fruits. 2-O-beta-D-Glucopyranuronosyl-D-mannose is found in fruits. Present as a structural unit in plant gums, e.g. damson (Prunus insitia), cherry (Prunus cerasus), Anogeissus lattifolia (gum ghatti).

   

beta-D-Glucopyranose, 6-[3-(4-hydroxy-3-methoxyphenyl)-2-propenoate], (E)-

beta-D-Glucopyranose, 6-[3-(4-hydroxy-3-methoxyphenyl)-2-propenoate], (E)-

C16H20O9 (356.110727)


   

Acaciabiuronic acid

3,4,5-trihydroxy-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxane-2-carboxylic acid

C12H20O12 (356.09547200000003)


Acaciabiuronic acid is found in cereals and cereal products. Probably the commonest aldobiouronic acid present as a structural unit in plant gums. It is isolated from partial acid hydrolysates from the following plants; black wattle (Acacia mollissima), Acacia senegal, Acacia pycnantha, Acacia karroo, Acacia cyanophylla, egg plum (Prunus domestica), almond (Prunus amygdalus), peach (Prunus persica), Anogeissus lattifolia (gum ghatti), Vigilia oroboides, Afraegle paniculata, Ferula and Chorisia species Also isolated from hydrolysates of maritime pine (Pinus pinaster) hemicellulose and wheat stra

   

Veranisatin B

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

C16H20O9 (356.110727)


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

   

3-O-beta-D-Galactopyranuronosyl-D-galactose

3,4,5-trihydroxy-6-{[2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}oxane-2-carboxylic acid

C12H20O12 (356.09547200000003)


3-O-beta-D-Galactopyranuronosyl-D-galactose is found in fruits. 3-O-beta-D-Galactopyranuronosyl-D-galactose is isolated from Spondias dulcis (ambarella) gum. Isolated from Spondias dulcis (ambarella) gum. 3-O-beta-D-Galactopyranuronosyl-D-galactose is found in fruits.

   

Xerocomic acid

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

C18H12O8 (356.0532152)


Xerocomic acid is found in mushrooms. Xerocomic acid is isolated from Boletus erythropus (dotted-stem bolete) and Gomphidius glutinosus (spike cap

   

Grevilline C

(6E)-4-(3,4-dihydroxyphenyl)-6-[(3,4-dihydroxyphenyl)methylidene]-3-hydroxy-5,6-dihydro-2H-pyran-2,5-dione

C18H12O8 (356.0532152)


Grevilline C is found in mushrooms. Grevilline C is a pigment from Suillus grevillei (larch bolete). Pigment from Suillus grevillei (larch bolete). Grevilline C is found in mushrooms.

   

Grevilline D

(6E)-4-(2,5-dihydroxyphenyl)-6-[(3,4-dihydroxyphenyl)methylidene]-3-hydroxy-5,6-dihydro-2H-pyran-2,5-dione

C18H12O8 (356.0532152)


Grevilline D is found in mushrooms. Grevilline D is a pigment from Suillus grevillei (larch bolete). Pigment from Suillus grevillei (larch bolete). Grevilline D is found in mushrooms.

   

Dihydrohydroxy-O-methylsterigmatocystin

5-hydroxy-11,15-dimethoxy-6,8,20-trioxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1(12),2(9),10,14,16,18-hexaen-13-one

C19H16O7 (356.0895986)


Dihydrohydroxy-O-methylsterigmatocystin is a mycotoxin produced by Aspergillus parasiticus. Mycotoxin production by Aspergillus parasiticus.

   

1-O-2'-Hydroxy-4'-methoxycinnamoyl-b-D-glucose

3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E)-3-(2-hydroxy-4-methoxyphenyl)prop-2-enoic acid

C16H20O9 (356.110727)


1-O-2-Hydroxy-4-methoxycinnamoyl-b-D-glucose is found in fats and oils. 1-O-2-Hydroxy-4-methoxycinnamoyl-b-D-glucose is a constituent of Matricaria chamomilla (German chamomile). Constituent of Matricaria chamomilla (German chamomile). 1-O-2-Hydroxy-4-methoxycinnamoyl-b-D-glucose is found in tea, fats and oils, and herbs and spices.

   

Caffeic acid 3-O-glucuronide

(2S,3S,4S,5R,6S)-6-{5-[(1E)-2-carboxyeth-1-en-1-yl]-2-hydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H16O10 (356.0743436)


Caffeic acid 3-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).

   

Caffeic acid 4-O-glucuronide

(2S,3S,4S,5R,6S)-6-{4-[(1E)-2-carboxyeth-1-en-1-yl]-2-hydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H16O10 (356.0743436)


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

   

Caffeoyl C1-glucuronide

(2S,3S,4S,5R,6S)-6-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H16O10 (356.0743436)


Caffeoyl C1-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).

   

Diphenylmercury

Diphenylmercury

C12H10Hg (356.048878)


Diphenylmercury belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.

   

3,5-Dihydroxycinnamic acid glucuronide

(2R,4R,6R)-6-{3-[(1E)-2-carboxyeth-1-en-1-yl]-5-hydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H16O10 (356.0743436)


   

2-[6-Fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]-1-indenyl]acetic acid

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

C20H17FO3S (356.0882384)


   

5-[[4-[2-(5-Ethylpyridin-2-yl)ethoxy]phenyl]methyl]-4-hydroxy-3H-1,3-thiazol-2-one

5-({4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl}methyl)-4-hydroxy-2,3-dihydro-1,3-thiazol-2-one

C19H20N2O3S (356.119457)


   

Bisdethiobis(methylthio)gliotoxin

6-hydroxy-3-(hydroxymethyl)-2-methyl-3,10a-bis(methylsulfanyl)-1H,2H,3H,4H,5aH,6H,10H,10aH-piperazino[1,2-a]indole-1,4-dione

C15H20N2O4S2 (356.08644400000003)


   

Apricoxib

4-[2-(4-Ethoxyphenyl)-4-methyl-1H-pyrrol-1-yl]benzene-1-sulphonamide

C19H20N2O3S (356.119457)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C80509 - COX-2 Inhibitor C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor

   

Gentiopicroside

5-ethenyl-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,3H,5H,6H-pyrano[3,4-c]pyran-1-one

C16H20O9 (356.110727)


   

Glucose lactate lactate

2-Hydroxy-2-[2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]propanoyl 2-hydroxypropaneperoxoic acid

C12H20O12 (356.09547200000003)


   

(S)-2-((6,7-Dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)acetic acid

(S)-2-((6,7-Dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)acetic acid

C17H18Cl2O4 (356.05820880000005)


   

Laquinimod

5-chloro-N-ethyl-4-hydroxy-1-methyl-2-oxo-N-phenyl-1,2-dihydroquinoline-3-carboxamide

C19H17ClN2O3 (356.09276420000003)


C308 - Immunotherapeutic Agent N - Nervous system

   

N-(2,4-Dinitrophenyl)-5-methoxytryptamine

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2,4-dinitroaniline

C17H16N4O5 (356.1120646)


   

Cyclohexyl-[cyclohexyl(sulfo)amino]sulfamic acid

N-Cyclohexyl-N-[cyclohexyl(sulphO)amino]sulphamic acid

C12H24N2O6S2 (356.1075724)


   

1-O-Feruloyl-beta-D-glucopyranose

(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid

C16H20O9 (356.110727)


1-o-feruloyl-beta-d-glucopyranose is a member of the class of compounds known as hydroxycinnamic acid glycosides. Hydroxycinnamic acid glycosides are glycosylated hydoxycinnamic acids derivatives. 1-o-feruloyl-beta-d-glucopyranose is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 1-o-feruloyl-beta-d-glucopyranose can be found in loquat, which makes 1-o-feruloyl-beta-d-glucopyranose a potential biomarker for the consumption of this food product.

   

1-O-Feruloyl-beta-D-glucose

(3R,4S,5S,6R)-2,4,5-Trihydroxy-6-(hydroxymethyl)oxan-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

C16H20O9 (356.110727)


1-o-feruloyl-beta-d-glucose belongs to coumaric acids and derivatives class of compounds. Those are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. 1-o-feruloyl-beta-d-glucose is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 1-o-feruloyl-beta-d-glucose can be found in a number of food items such as chives, yellow bell pepper, white cabbage, and orange bell pepper, which makes 1-o-feruloyl-beta-d-glucose a potential biomarker for the consumption of these food products.

   

Aldobionic acid

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-{[(2R,3R,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy}oxane-2-carboxylic acid

C12H20O12 (356.09547200000003)


Aldobionic acid, also known as beta-D-glca-(1->6)-beta-D-gal or glcab1-6galb, is a member of the class of compounds known as O-glucuronides. O-glucuronides are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond. Aldobionic acid is soluble (in water) and a weakly acidic compound (based on its pKa). Aldobionic acid can be found in quince, which makes aldobionic acid a potential biomarker for the consumption of this food product.

   

Aldobiouronic acid

3,4,5-Trihydroxy-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-2-yl formic acid

C12H20O12 (356.09547200000003)


Aldobiouronic acid is also known as aldobiouronate. Aldobiouronic acid is soluble (in water) and a very weakly acidic compound (based on its pKa). Aldobiouronic acid can be found in almond and corn, which makes aldobiouronic acid a potential biomarker for the consumption of these food products.

   

6-Formylisoophiopogonanone A

3-(1,3-Benzodioxol-5-ylmethyl)-3,4-dihydro-5,7-dihydroxy-8-methyl-4-oxo-2H-1-benzopyran-6-carboxaldehyde

C19H16O7 (356.0895986)


   

Butyrolactone II

Methyl 4-hydroxy-2-(4-hydroxybenzyl)-3-(4-hydroxyphenyl)-5-oxo-2,5-dihydro-2-furancarboxylate

C19H16O7 (356.0895986)


   

justiflorinol

justiflorinol

C19H16O7 (356.0895986)


A natural product found in Piper sanguineispicum.

   
   

trans-p-feruloyl-beta-D-glucopyranoside

trans-p-feruloyl-beta-D-glucopyranoside

C16H20O9 (356.110727)


Lavandoside is an active compound found from Lavandula spica flowers[1].

   
   

Paeciloquinone A

(+-)-1,3,6,8-Tetrahydroxy-2-(tetrahydro-2-oxo-3-furanyl)-9,10-anthracenedione

C18H12O8 (356.0532152)


   

(+)-Usararotenoid A

(6aR,12aS)-12a-Hydroxy-2,3,8,9-bis(methylenedioxy)rotenone

C18H12O8 (356.0532152)


   
   
   

4,2-Epoxy-5,7,4,5-tetramethoxy-3-phenylcoumarin

4,2-Epoxy-5,7,4,5-tetramethoxy-3-phenylcoumarin

C19H16O7 (356.0895986)


   

Komodoquinone B

Komodoquinone B

C19H16O7 (356.0895986)


A member of the class of tetracenequinones that is 7,8,9,10-tetrahydrotetracene-5,12-dione carrying hydroxy groups at positions 1, 6, 8S, 10S and 11 and a methyl group at position 8S. It is the aglycone of komodoquinone A which was isolated from the marine bacterium Streptomyces sp. KS3.

   
   

7-Hydroxycymopochromanone

(-)-7-Hydroxycymopochromanone

C16H21BrO4 (356.06231260000004)


   

1-O-Feruloyl-beta-D-glucopyranose

1-O-Feruloyl-beta-D-glucopyranose

C16H20O9 (356.110727)


   

Ophiopogonanone C

Ophiopogonanone C

C19H16O7 (356.0895986)


   
   
   

Repenone

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

C18H12O8 (356.0532152)


   
   

5,7,8-Trimethoxy-3,4-methylenedioxyisoflavone

5,7,8-Trimethoxy-3,4-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   
   

11-Acetoxy-2-bromo-3-hydroxy-beta-chamigrene

11-Acetoxy-2-bromo-3-hydroxy-beta-chamigrene

C17H25BrO3 (356.098696)


   

Isognaphalin 8-acetate

Isognaphalin 8-acetate

C19H16O7 (356.0895986)


   

Ferulic acid 4-O-beta-glucopyranoside

Ferulic acid 4-O-beta-glucopyranoside

C16H20O9 (356.110727)


   

Isokanugin

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

C19H16O7 (356.0895986)


   

Ageconyflavone A

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

C19H16O7 (356.0895986)


   

Dihydrohydroxy-O-methylsterigmatocystin

5-hydroxy-11,15-dimethoxy-6,8,20-trioxapentacyclo[10.8.0.0^{2,9}.0^{3,7}.0^{14,19}]icosa-1,9,11,14,16,18-hexaen-13-one

C19H16O7 (356.0895986)


   

Iriskumaonin methyl ether

5,3,4-Trimethoxy-6,7-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

5,7,3-Trimethoxy-4,5-methylenedioxyflavone

5,7,3-Trimethoxy-4,5-methylenedioxyflavone

C19H16O7 (356.0895986)


   

Demethyltorosaflavone D

(E)- 3-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-6-yl]-2-propenoic acid

C18H12O8 (356.0532152)


   

Milldurone

6,7-Dimethoxy-3- (6-methoxy-1,3-benzodioxol-5-yl) -4H-1-benzopyran-4-one

C19H16O7 (356.0895986)


   

6,7,3-Trimethoxy-4,5-methylenedioxyisoflavone

6,7,3-Trimethoxy-4,5-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

7,8,2-Trimethoxy-4,5-methylenedioxyisoflavone

7,8,2-Trimethoxy-4,5-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

8,3,4-Trimethoxy-6,7-methylenedioxyisoflavone

8,3,4-Trimethoxy-6,7-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

Odorantin

5,6,7-Trimethoxy-3,4-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan

2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan

C18H12O8 (356.0532152)


   

derrusnin

4,5,7-Trimethoxy-3- (3,4-methylenedioxyphenyl) coumarin

C19H16O7 (356.0895986)


   

Hemerocallone

5,2,5-Trimethoxy-6,7-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

Dimethyl gliotoxin

Bisdethiobis(methylthio)gliotoxin

C15H20N2O4S2 (356.08644400000003)


   

Kanugin

3,7-Dimethoxy-2- (7-methoxy-1,3-benzodioxole-5-yl) -4H-1-benzopyran-4-one

C19H16O7 (356.0895986)


   

Petalostetin

6,7,8-Trimethoxy-3,4-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   
   

2-{3-Phenyl-3-[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)thio]prop-2-enylidene}malononitrile

2-{3-Phenyl-3-[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)thio]prop-2-enylidene}malononitrile

C19H12N6S (356.08441120000003)


   

O1-(4-Chlorobenzoyl)-2-[(2-furylmethyl)sulfonyl]ethanehydroximamide

O1-(4-Chlorobenzoyl)-2-[(2-furylmethyl)sulfonyl]ethanehydroximamide

C14H13ClN2O5S (356.0233678)


   
   

Ethyl 2-{[2-cyano-3-(4-hydroxyphenyl)acryloyl]amino}-4-methylthiophene-3-carboxylate

Ethyl 2-{[2-cyano-3-(4-hydroxyphenyl)acryloyl]amino}-4-methylthiophene-3-carboxylate

C18H16N2O4S (356.08307360000003)


   

(Z)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

(Z)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

C16H20O9 (356.110727)


   
   
   

diMe-STA2DC

diMe-STA2DC

C16H20O7S (356.09296900000004)


Literature spectrum; CONFIDENCE Tentative identification: isomers possible (Level 3); Could be alkyl homologue of given structure; Digitised from figure: approximate intensities

   

Coumaroyl + C6H9O8 (isomer of 844, 845, 846)

Coumaroyl + C6H9O8 (isomer of 844, 845, 846)

C15H16O10 (356.0743436)


Annotation level-3

   

4-O-(4-carboxymethyl-2,4,6-trihydroxycyclohexyl)vanillic acid

4-O-(4-carboxymethyl-2,4,6-trihydroxycyclohexyl)vanillic acid

C16H20O9 (356.110727)


   

5-Hydroxy-6-methylchromone-7-O-??-D-glucoside

5-Hydroxy-6-methylchromone-7-O-??-D-glucoside

C16H20O9 (356.110727)


   

2-O-(beta-D-Glucopyranosyluronsaeure)-D-mannose|2-O-(beta-D-Glucuronpyranosyl)-D-mannose|O1-D-mannose-2-yl-beta-D-glucopyranuronic acid|O1-D-Mannose-2-yl-beta-D-glucopyranuronsaeure

2-O-(beta-D-Glucopyranosyluronsaeure)-D-mannose|2-O-(beta-D-Glucuronpyranosyl)-D-mannose|O1-D-mannose-2-yl-beta-D-glucopyranuronic acid|O1-D-Mannose-2-yl-beta-D-glucopyranuronsaeure

C12H20O12 (356.09547200000003)


   
   

(Z)-methyl lespedezate

(Z)-methyl lespedezate

C16H20O9 (356.110727)


   

Ferulic acid O-hexoside

Ferulic acid O-hexoside

C16H20O9 (356.110727)


   

Aldehydoisoophiopogonanone A, 6-

Aldehydoisoophiopogonanone A, 6-

C19H16O7 (356.0895986)


   

1-O-caffeoyl-beta-D-glucose

1-O-caffeoyl-beta-D-glucose

C16H20O9 (356.110727)


   

Erioside

6,8-Dihydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

C15H16O10 (356.0743436)


Erioside is a natural product found in Morus alba and Lasiosiphon glaucus with data available.

   

Isoxerocomic acid

Isoxerocomic acid

C18H12O8 (356.0532152)


   

4-O-(alpha-D-Galactopyranosyluronsaeure)-D-galactose|4-O-(alpha-D-Galactopyranosyluronsaeure)-D-galaktose|alpha-D-GalpA1 -> 4 D-Galp

4-O-(alpha-D-Galactopyranosyluronsaeure)-D-galactose|4-O-(alpha-D-Galactopyranosyluronsaeure)-D-galaktose|alpha-D-GalpA1 -> 4 D-Galp

C12H20O12 (356.09547200000003)


   

Gentiopicrosid|Kautaurin

Gentiopicrosid|Kautaurin

C16H20O9 (356.110727)


   

5-Hydroxypsorospermin

5-Hydroxypsorospermin

C19H16O7 (356.0895986)


   

1alpha,4alpha-dihydroxy-3beta-chloro-8alpha-acetoxyguai-10(14),11(13)-dien-6alpha,12-olide|8alpha-acetoxy-3beta-chloro-1alpha,4alpha-dihydroxyguai-10(14),11(13)-dien-6alpha,12-olide

1alpha,4alpha-dihydroxy-3beta-chloro-8alpha-acetoxyguai-10(14),11(13)-dien-6alpha,12-olide|8alpha-acetoxy-3beta-chloro-1alpha,4alpha-dihydroxyguai-10(14),11(13)-dien-6alpha,12-olide

C17H21ClO6 (356.10265960000004)


   

beta1-Rhodomycinon

beta1-Rhodomycinon

C19H16O7 (356.0895986)


   

1alpha,4alpha-dihydroxy-3beta-chloro-8alpha-acetoxyguai-9,11(13)-dien-6alpha,12-olide|8alpha-acetoxy-3beta-chloro-1alpha,4alpha-dihydroxyguai-9,11(13)-dien-6alpha,12-olide

1alpha,4alpha-dihydroxy-3beta-chloro-8alpha-acetoxyguai-9,11(13)-dien-6alpha,12-olide|8alpha-acetoxy-3beta-chloro-1alpha,4alpha-dihydroxyguai-9,11(13)-dien-6alpha,12-olide

C17H21ClO6 (356.10265960000004)


   

1-(2,5-Dihydroxy-4-bromophenyl)-3-hydroxy-3,7-dimethyl-6-octene-1-one

1-(2,5-Dihydroxy-4-bromophenyl)-3-hydroxy-3,7-dimethyl-6-octene-1-one

C16H21BrO4 (356.06231260000004)


   

3,3-dihydroxy-6-O-desmethylterphenyllin

3,3-dihydroxy-6-O-desmethylterphenyllin

C19H16O7 (356.0895986)


A para-terphenyl that is 6-O-desmethylterphenyllin substituted by additional hydroxy groups at positions 3 and 3. Isolated from Penicillium chermesinum, it exhibits inhibitory activity against alpha-glucosidase.

   
   

5-O-alpha-D-glucopyranosyl-5-hydroxymellein

5-O-alpha-D-glucopyranosyl-5-hydroxymellein

C16H20O9 (356.110727)


   
   

8-hydroxy-3,4-dimeth-oxy-1-methyl-anthraquinone-2-carboxylic acid methyl ester

8-hydroxy-3,4-dimeth-oxy-1-methyl-anthraquinone-2-carboxylic acid methyl ester

C19H16O7 (356.0895986)


   

tri-O-methylnorbergenin

tri-O-methylnorbergenin

C16H20O9 (356.110727)


   
   
   

(SC2RC7RS)-gamma-glutamyl-S-benzylcysteine sulfoxide|(SC2RC7SS)-gamma-glutamyl-S-benzylcysteine sulfoxide|gamma-L-glutamyl-petiveriin A|gamma-L-glutamyl-petiveriin B|??-L-Glutamyl-petiveriin A|??-L-Glutamyl-petiveriin B

(SC2RC7RS)-gamma-glutamyl-S-benzylcysteine sulfoxide|(SC2RC7SS)-gamma-glutamyl-S-benzylcysteine sulfoxide|gamma-L-glutamyl-petiveriin A|gamma-L-glutamyl-petiveriin B|??-L-Glutamyl-petiveriin A|??-L-Glutamyl-petiveriin B

C15H20N2O6S (356.10420200000004)


   

1-butanoyl-2,4,5-trihydroxy-7-methoxyanthracene-9,10-dione

1-butanoyl-2,4,5-trihydroxy-7-methoxyanthracene-9,10-dione

C19H16O7 (356.0895986)


   
   
   

O2-alpha-D-glucopyranosyl-D-glucuronic acid|O2-alpha-D-Glucopyranosyl-D-glucuronsaeure

O2-alpha-D-glucopyranosyl-D-glucuronic acid|O2-alpha-D-Glucopyranosyl-D-glucuronsaeure

C12H20O12 (356.09547200000003)


   

1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-2,3-naphthalenedicarboxylic acid

1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-2,3-naphthalenedicarboxylic acid

C18H12O8 (356.0532152)


   

demethoxyisodaphnneticin|trans-2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-9H-pyrano[2,3-f]-1,4-benzodioxin-9-one

demethoxyisodaphnneticin|trans-2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-9H-pyrano[2,3-f]-1,4-benzodioxin-9-one

C19H16O7 (356.0895986)


   

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,|psorofebrin

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,|psorofebrin

C19H16O7 (356.0895986)


   

Garcinexanthone F

Garcinexanthone F

C18H12O8 (356.0532152)


   
   

(7E,9R,10R,13E,15Z)-16-bromo-9,10-dihydroxyhexadeca-7,13,15-trien-5-ynoic acid|xestospongienol K

(7E,9R,10R,13E,15Z)-16-bromo-9,10-dihydroxyhexadeca-7,13,15-trien-5-ynoic acid|xestospongienol K

C16H21BrO4 (356.06231260000004)


   

Diplotasin

Diplotasin

C19H16O7 (356.0895986)


A hydroxyhomoflavonoid that is isochromeno[4,3-b]chromen-7(5H)-one substituted by a hydroxy group at position 4 and methoxy groups at positions 3, 10 and 11. It has been isolated from Mimosa diplotricha.

   

1-hydroxy-1-[tetrahydro-4-hydroxy-2-(hydroxymethyl)-5-oxofuran-2-yl]propan-2-yl 2,4-dihydroxy-6-methylbenzoate

1-hydroxy-1-[tetrahydro-4-hydroxy-2-(hydroxymethyl)-5-oxofuran-2-yl]propan-2-yl 2,4-dihydroxy-6-methylbenzoate

C16H20O9 (356.110727)


   
   

[2-(1,2-dihydroxypropyl)tetrahydro-4-hydroxy-5-oxofuran-2-yl]methyl 2,4-dihydroxy-6-methylbenzoate

[2-(1,2-dihydroxypropyl)tetrahydro-4-hydroxy-5-oxofuran-2-yl]methyl 2,4-dihydroxy-6-methylbenzoate

C16H20O9 (356.110727)


   

Rugosaflavonoid B

Rugosaflavonoid B

C19H16O7 (356.0895986)


   
   
   

1,3,6-Trihydroxy-5-methoxy-7-(2-oxo-3-methyl-3-butenyl)-9H-xanthene-9-one

1,3,6-Trihydroxy-5-methoxy-7-(2-oxo-3-methyl-3-butenyl)-9H-xanthene-9-one

C19H16O7 (356.0895986)


   
   
   

Russupteridine yellow I

Russupteridine yellow I

C12H16N6O7 (356.1080426)


   

9-(toluene-4-sulfonyloxy)-furo[3,2-g]chromen-7-one

9-(toluene-4-sulfonyloxy)-furo[3,2-g]chromen-7-one

C18H12O6S (356.0354572)


   

2-C-carboxy-3-deoxy-5-O-alpha-D-galactopyranosyl-D-pentonic acid

2-C-carboxy-3-deoxy-5-O-alpha-D-galactopyranosyl-D-pentonic acid

C12H20O12 (356.09547200000003)


   

5,7,8-trihydroxycoumarin-5-beta-glucopyranoside

5,7,8-trihydroxycoumarin-5-beta-glucopyranoside

C15H16O10 (356.0743436)


   

6-O-(beta-D-Galaktopyranosyluronsaeure)-L-galactose|6-O-(beta-D-Glucopyranosyluronsaeure)-D-galactose|6-O-(beta-D-Glucuronpyranosyl)-D-galactose|O1-D-galactose-6-yl-beta-D-glucopyranuronic acid|O1-D-Galactose-6-yl-beta-D-glucopyranuronsaeure

6-O-(beta-D-Galaktopyranosyluronsaeure)-L-galactose|6-O-(beta-D-Glucopyranosyluronsaeure)-D-galactose|6-O-(beta-D-Glucuronpyranosyl)-D-galactose|O1-D-galactose-6-yl-beta-D-glucopyranuronic acid|O1-D-Galactose-6-yl-beta-D-glucopyranuronsaeure

C12H20O12 (356.09547200000003)


   

4-deoxydothistromin

4-deoxydothistromin

C18H12O8 (356.0532152)


   
   

4-beta-D-glucopyranosyloxy-3-hydroxy-trans-cinnamic acid methyl ester|methyl 4-(beta-D-glucopyranosyl)caffeate|methyl 4-beta-D-glucopyranosylcaffeate|methyl 4-O-(beta-D-glucopyranosyl)-caffeate|methyl 4-O-beta-D-glucopyranosylcaffeate|methyl 4-O-beta-glucopyranosyl-(E)-caffeate|methyl-4-O-(beta-D-glucopyranosyl)caffeate

4-beta-D-glucopyranosyloxy-3-hydroxy-trans-cinnamic acid methyl ester|methyl 4-(beta-D-glucopyranosyl)caffeate|methyl 4-beta-D-glucopyranosylcaffeate|methyl 4-O-(beta-D-glucopyranosyl)-caffeate|methyl 4-O-beta-D-glucopyranosylcaffeate|methyl 4-O-beta-glucopyranosyl-(E)-caffeate|methyl-4-O-(beta-D-glucopyranosyl)caffeate

C16H20O9 (356.110727)


   
   

5,7-Dihydroxy-3-(4-hydroxy-1,3-benzodioxole-5-ylmethyl)-6,8-dimethyl-4H-1-benzopyran-4-one

5,7-Dihydroxy-3-(4-hydroxy-1,3-benzodioxole-5-ylmethyl)-6,8-dimethyl-4H-1-benzopyran-4-one

C19H16O7 (356.0895986)


   
   
   
   

demethoxydaphneticin

demethoxydaphneticin

C19H16O7 (356.0895986)


   

5,6,7-Trimethoxy-3,4-methylenedioxyisoflavone

5,6,7-Trimethoxy-3,4-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

methyl 3-O-beta-D-glucopyranosyl-5-hydroxycinnamate

methyl 3-O-beta-D-glucopyranosyl-5-hydroxycinnamate

C16H20O9 (356.110727)


   

6a,12a-Dehydrosermundone

6a,12a-Dehydrosermundone

C19H16O7 (356.0895986)


   
   

3-[5-(1,2-dihydroxy-ethyl)-3,4-dihydroxy-2-oxo-tetrahydro-furan-3-yl]-3-(4-hydroxy-phenyl)-propionic acid methyl ester|Reflexin

3-[5-(1,2-dihydroxy-ethyl)-3,4-dihydroxy-2-oxo-tetrahydro-furan-3-yl]-3-(4-hydroxy-phenyl)-propionic acid methyl ester|Reflexin

C16H20O9 (356.110727)


   

terephthalic acid mono-[2-(4-carboxy-phenoxycarbonyl)-vinyl] ester

terephthalic acid mono-[2-(4-carboxy-phenoxycarbonyl)-vinyl] ester

C18H12O8 (356.0532152)


   
   

luteolin 8-C-E-propenoic acid

luteolin 8-C-E-propenoic acid

C18H12O8 (356.0532152)


   

9,10-Dihydro-7-hydroxy-3,8-dimethoxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid methyl ester

9,10-Dihydro-7-hydroxy-3,8-dimethoxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid methyl ester

C19H16O7 (356.0895986)


   
   
   
   

Z-GMCA

(E)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

C16H20O9 (356.110727)


2-O-Glucosyloxy-4-methoxycinnamic acid is a natural product found in Chrysanthemum indicum, Mikania hirsutissima, and Ficus sagittata with data available.

   

cis-Ferulic acid 4-O-β-D-glucopyranoside

CIS-FERULIC ACID 4-O-BETA-D-GLUCOPYRANOSIDE

C16H20O9 (356.110727)


cis-Ferulic acid 4-O-beta-D-glucopyranoside is a natural product found in Equisetum hyemale and Onobrychis viciifolia with data available.

   

6-formyl-isoophiopogonanone A

3-(1,3-Benzodioxol-5-ylmethyl)-3,4-dihydro-5,7-dihydroxy-8-methyl-4-oxo-2H-1-benzopyran-6-carboxaldehyde

C19H16O7 (356.0895986)


   

Chebulic_acid

BUTANEDIOIC ACID, (3-CARBOXY-3,4-DIHYDRO-5,6,7-TRIHYDROXY-1-OXO-1H-2-BENZOPYRAN-4-YL)-, (3S-(3.ALPHA.,4.BETA.(R*)))-

C14H12O11 (356.0379602)


Chebulic acid is a natural product found in Terminalia chebula, Terminalia citrina, and Phyllanthus emblica with data available. Chebulic acid, a phenolcarboxylic acid compound isolated from Terminalia chebula, has potent anti-oxidant activity, which breaks the cross-links of proteins induced by advanced glycation end-products (AGEs) and inhibits the formation of AGEs. Chebulic acid is effective in controlling elevated metabolic parameters, oxidative stress and renal damage, supporting its beneficial effect in diabetic nephropathy[1][2]. Chebulic acid, a phenolcarboxylic acid compound isolated from Terminalia chebula, has potent anti-oxidant activity, which breaks the cross-links of proteins induced by advanced glycation end-products (AGEs) and inhibits the formation of AGEs. Chebulic acid is effective in controlling elevated metabolic parameters, oxidative stress and renal damage, supporting its beneficial effect in diabetic nephropathy[1][2].

   

Pioglitazone

5-(4-(2-(5-Ethylpyridin-2-yl)ethoxy)benzyl)thiazolidine-2,4-dione

C19H20N2O3S (356.119457)


A - Alimentary tract and metabolism > A10 - Drugs used in diabetes > A10B - Blood glucose lowering drugs, excl. insulins > A10BG - Thiazolidinediones C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C98241 - Thiazolidinedione Antidiabetic Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D007004 - Hypoglycemic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3418; ORIGINAL_PRECURSOR_SCAN_NO 3417 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3413; ORIGINAL_PRECURSOR_SCAN_NO 3410 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3422; ORIGINAL_PRECURSOR_SCAN_NO 3421 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3410; ORIGINAL_PRECURSOR_SCAN_NO 3408 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3260; ORIGINAL_PRECURSOR_SCAN_NO 3258 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3419; ORIGINAL_PRECURSOR_SCAN_NO 3417 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7098; ORIGINAL_PRECURSOR_SCAN_NO 7097 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7118; ORIGINAL_PRECURSOR_SCAN_NO 7116 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7127; ORIGINAL_PRECURSOR_SCAN_NO 7125 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7146; ORIGINAL_PRECURSOR_SCAN_NO 7145 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7154; ORIGINAL_PRECURSOR_SCAN_NO 7153 CONFIDENCE standard compound; INTERNAL_ID 289; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7069; ORIGINAL_PRECURSOR_SCAN_NO 7068 CONFIDENCE standard compound; INTERNAL_ID 2358 CONFIDENCE standard compound; INTERNAL_ID 2203 CONFIDENCE standard compound; INTERNAL_ID 8526 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3286 Pioglitazone (U 72107) is an orally active and selective PPARγ (peroxisome proliferator-activated receptor) agonist with high affinity binding to the PPARγ ligand-binding domain with EC50 of 0.93 and 0.99 μM for human and mouse PPARγ, respectively. Pioglitazone can be used in diabetes research[2][3][4].

   

gentiopicroside

gentiopicroside

C16H20O9 (356.110727)


Annotation level-1 Gentiopicroside, a naturally occurring iridoid glycoside, inhibits P450 activity, with an IC50 and a Ki of 61 μM and 22.8 μM for CYP2A6; Gentiopicroside has anti-inflammatoryand antioxidative effects. Gentiopicroside, a naturally occurring iridoid glycoside, inhibits P450 activity, with an IC50 and a Ki of 61 μM and 22.8 μM for CYP2A6; Gentiopicroside has anti-inflammatoryand antioxidative effects.

   
   

Butyrolactone II_130093

Butyrolactone II_130093

C19H16O7 (356.0895986)


   

(E)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

NCGC00180844-02!(E)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

C16H20O9 (356.110727)


   

methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-5-oxofuran-2-carboxylate

NCGC00180622-03!methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-5-oxofuran-2-carboxylate

C19H16O7 (356.0895986)


   

2-hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid

NCGC00385404-01!2-hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid

C16H20O7S (356.09296900000004)


   

7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

NCGC00380487-01!7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

C19H16O7 (356.0895986)


   

C15H20N2O4S2_Pyrazino[1,2-a]indole-1,4-dione, 2,3,5a,6,10,10a-hexahydro-6-hydroxy-3-(hydroxymethyl)-2-methyl-3,10a-bis(methylthio)-, (3R,5aS,6S,10aR)

NCGC00380667-01_C15H20N2O4S2_Pyrazino[1,2-a]indole-1,4-dione, 2,3,5a,6,10,10a-hexahydro-6-hydroxy-3-(hydroxymethyl)-2-methyl-3,10a-bis(methylthio)-, (3R,5aS,6S,10aR)-

C15H20N2O4S2 (356.08644400000003)


   

C16H20O9_2-Propenoic acid, 3-[2-(beta-D-glucopyranosyloxy)-4-methoxyphenyl]-, (2Z)

NCGC00384792-01_C16H20O9_2-Propenoic acid, 3-[2-(beta-D-glucopyranosyloxy)-4-methoxyphenyl]-, (2Z)-

C16H20O9 (356.110727)


   

(E)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

(E)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

C16H20O9 (356.110727)


   

7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

C19H16O7 (356.0895986)


   

Bisdethiobis(methylthio)gliotoxin

Bisdethiobis(methylthio)gliotoxin

C15H20N2O4S2 (356.08644400000003)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-5-oxofuran-2-carboxylate

methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-5-oxofuran-2-carboxylate

C19H16O7 (356.0895986)


   

Sulindac

Sulindac aka 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]acetic acid

C20H17FO3S (356.0882384)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances 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 D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors

   

Coumaroyl + C6H9O8 (isomer of 843, 844, 846)

Coumaroyl + C6H9O8 (isomer of 843, 844, 846)

C15H16O10 (356.0743436)


Annotation level-3

   

Coumaroyl + C6H9O8 (isomer of 843, 845, 846)

Coumaroyl + C6H9O8 (isomer of 843, 845, 846)

C15H16O10 (356.0743436)


Annotation level-3

   

Coumaroyl + C6H9O8 (isomer of 843, 844, 845)

Coumaroyl + C6H9O8 (isomer of 843, 844, 845)

C15H16O10 (356.0743436)


Annotation level-3

   

Feruloyl Hexoside (isomer of 847)

Feruloyl Hexoside (isomer of 847)

C16H20O9 (356.110727)


Annotation level-3

   

Feruloyl Hexoside (isomer of 849)

Feruloyl Hexoside (isomer of 849)

C16H20O9 (356.110727)


Annotation level-3

   

7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one [IIN-based on: CCMSLIB00000848673]

NCGC00380487-01!7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one [IIN-based on: CCMSLIB00000848673]

C19H16O7 (356.0895986)


   

2-hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid [IIN-based on: CCMSLIB00000848339]

NCGC00385404-01!2-hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid [IIN-based on: CCMSLIB00000848339]

C16H20O7S (356.09296900000004)


   

2-hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid [IIN-based: Match]

NCGC00385404-01!2-hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid [IIN-based: Match]

C16H20O7S (356.09296900000004)


   

7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one [IIN-based: Match]

NCGC00380487-01!7,9-dimethoxy-6-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one [IIN-based: Match]

C19H16O7 (356.0895986)


   

3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-g]chromen-7-one

3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-g]chromen-7-one

C19H16O7 (356.0895986)


   

(Z)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid_major

(Z)-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid_major

C16H20O9 (356.110727)


   

bisdethiobis(methylthio)gliotoxin_major

bisdethiobis(methylthio)gliotoxin_major

C15H20N2O4S2 (356.08644400000003)


   

methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-5-oxofuran-2-carboxylate_major

methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-5-oxofuran-2-carboxylate_major

C19H16O7 (356.0895986)


   
   

BISSALICYL FUMARATE

BISSALICYL FUMARATE

C18H12O8 (356.0532152)


   

Odoratine

5,6,7-Trimethoxy-3,4-methylenedioxyisoflavone

C19H16O7 (356.0895986)


   

Thr-Asp-OH

(S)-2-(3-((R)-2-hydroxypropoxy)-4-nitrobenzamido)succinic acid

C14H16N2O9 (356.08557659999997)


   

Asp-Asp-OH

(S)-2-(3-(carboxymethoxy)-4-nitrobenzamido)pentanedioic acid

C13H12N2O10 (356.0491932)


   

Met-Val-OH

(S)-4-methyl-2-(3-(2-(methylthio)ethoxy)-4-nitrobenzamido)pentanoic acid

C15H20N2O6S (356.10420200000004)


   

Val-Met-OH

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

C15H20N2O6S (356.10420200000004)


   

Xerocomic acid

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

C18H12O8 (356.0532152)


   

Grevilline D

(6E)-4-(2,5-dihydroxyphenyl)-6-[(3,4-dihydroxyphenyl)methylidene]-3-hydroxy-5,6-dihydro-2H-pyran-2,5-dione

C18H12O8 (356.0532152)


   

Grevilline C

(6E)-4-(3,4-dihydroxyphenyl)-6-[(3,4-dihydroxyphenyl)methylidene]-3-hydroxy-5,6-dihydro-2H-pyran-2,5-dione

C18H12O8 (356.0532152)


   

(+)-Chebulic acid

2-(3-carboxy-5,6,7-trihydroxy-1-oxo-3,4-dihydro-1H-2-benzopyran-4-yl)butanedioic acid

C14H12O11 (356.0379602)


   

1-O-Feruloylglucose

3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C16H20O9 (356.110727)


   

Veranisatin B

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

C16H20O9 (356.110727)


   

1-O-2'-Hydroxy-4'-methoxycinnamoyl-b-D-glucose

3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E)-3-(2-hydroxy-4-methoxyphenyl)prop-2-enoate

C16H20O9 (356.110727)


   

Caffeic acid 3-O-glucuronide

(2S,3S,4S,5R,6S)-6-{5-[(1E)-2-carboxyeth-1-en-1-yl]-2-hydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H16O10 (356.0743436)


   

Caffeic acid 4-O-glucuronide

(2S,3S,4S,5R,6S)-6-{4-[(1E)-2-carboxyeth-1-en-1-yl]-2-hydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H16O10 (356.0743436)


   

Caffeoyl C1-glucuronide

(2S,3S,4S,5R,6S)-6-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H16O10 (356.0743436)


   

7,9-Dimethoxy-6-(4-methoxyphenyl)-8H-[1,3]dioxolo[4,5-g]chromen-8-one

7,9-Dimethoxy-6-(4-methoxyphenyl)-8H-[1,3]dioxolo[4,5-g]chromen-8-one

C19H16O7 (356.0895986)


   

2-Glucosyloxy-4-methoxycinnamic acid

2-Glucosyloxy-4-methoxycinnamic acid

C16H20O9 (356.110727)


   

3-(4-Bromobenzyl)-2-butyl-4-chloro-1H-imidazol-5-ylmethanol

3-(4-Bromobenzyl)-2-butyl-4-chloro-1H-imidazol-5-ylmethanol

C15H18BrClN2O (356.0290948)


   

5-[[4-(ACETYLAMINO)PHENYL]THIO]-1H-BENZIMIDAZOL-2-YL]-CARBAMIC ACID METHYL ESTER

5-[[4-(ACETYLAMINO)PHENYL]THIO]-1H-BENZIMIDAZOL-2-YL]-CARBAMIC ACID METHYL ESTER

C17H16N4O3S (356.0943066)


   

Minocromil

Minocromil

C18H16N2O6 (356.1008316)


C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist

   

succinimidyl 4-(p-maleimidophenyl)butyrate

succinimidyl 4-(p-maleimidophenyl)butyrate

C18H16N2O6 (356.1008316)


   

4-(6-Bromo-pyridin-2-yloxy)-piperidine-1-carboxylic acid tert-butyl ester

4-(6-Bromo-pyridin-2-yloxy)-piperidine-1-carboxylic acid tert-butyl ester

C15H21BrN2O3 (356.0735456)


   

1-(4-Sulfamoylphenyl)-1,6-dihydropyrazolo[3,4-e]indazole-3-carbox amide

1-[4-(Aminosulfonyl)phenyl]-1,6-dihydropyrazolo[3,4-E]indazole-3-carboxamide

C15H12N6O3S (356.06915620000007)


   

6-amino-4-(3-chloro-4-fluorophenylamino)-7-ethoxyquinoline-3-carbonitrile

6-amino-4-(3-chloro-4-fluorophenylamino)-7-ethoxyquinoline-3-carbonitrile

C18H14ClFN4O (356.0840116)


   

N-[[4-[5-methyl-3-phenylisoxazol-4-yl]phenyl]sulfonyl]acetamide

N-[[4-[5-methyl-3-phenylisoxazol-4-yl]phenyl]sulfonyl]acetamide

C18H16N2O4S (356.08307360000003)


   

4,5-DINITRO-9-OXO-9H-FLUORENE-2,7-DICARBOXAMIDE

4,5-DINITRO-9-OXO-9H-FLUORENE-2,7-DICARBOXAMIDE

C15H8N4O7 (356.0392978)


   

fletazepam

fletazepam

C17H13ClF4N2 (356.07033359999997)


C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent

   

1-iodo-4-(4-pentylcyclohexyl)benzene

1-iodo-4-(4-pentylcyclohexyl)benzene

C17H25I (356.100092)


   
   

1-[2-(acetoxy)ethyl]-2-oxopropyl [(4-amino-2-methyl-5-pyrimidinyl)methyl]dithiocarbamate

1-[2-(acetoxy)ethyl]-2-oxopropyl [(4-amino-2-methyl-5-pyrimidinyl)methyl]dithiocarbamate

C14H20N4O3S2 (356.09767700000003)


   

2,6-Bis(methylthio)-3,5-diphenyl-4H-thiopyran-4-one

2,6-Bis(methylthio)-3,5-diphenyl-4H-thiopyran-4-one

C19H16OS3 (356.0363246)


   

3,7-o-diacetylpinobanksin

3,7-o-diacetylpinobanksin

C19H16O7 (356.0895986)


   
   
   

2-CARBETHOXY-5,7-DIHYDROXY-4-METHOXYISOFLAVONE

2-CARBETHOXY-5,7-DIHYDROXY-4-METHOXYISOFLAVONE

C19H16O7 (356.0895986)


   

N-(3,4-DIPHENYL-3H-THIAZOL-2-YLIDENE)-BENZAMIDE

N-(3,4-DIPHENYL-3H-THIAZOL-2-YLIDENE)-BENZAMIDE

C22H16N2OS (356.0983286)


   

2-[(4-methoxy-2-nitrophenyl)azo]acetoacetanilide

2-[(4-methoxy-2-nitrophenyl)azo]acetoacetanilide

C17H16N4O5 (356.1120646)


   
   

(4-fluorophenyl)-[1-(4-nitrobenzoyl)piperidin-4-yl]methanone

(4-fluorophenyl)-[1-(4-nitrobenzoyl)piperidin-4-yl]methanone

C19H17FN2O4 (356.11722940000004)


   

[(3,5,6-trichloro-2-pyridyl)oxy]acetic acid, compound with triethylamine (1:1)

[(3,5,6-trichloro-2-pyridyl)oxy]acetic acid, compound with triethylamine (1:1)

C13H19Cl3N2O3 (356.04611940000007)


   

1-Iodo-4-(trans-4-pentylcyclohexyl)benzene

1-Iodo-4-(trans-4-pentylcyclohexyl)benzene

C17H25I (356.100092)


   

2,5-bis-Acetoacetamidobenzene sulfonic acid

2,5-bis-Acetoacetamidobenzene sulfonic acid

C14H16N2O7S (356.0678186)


   

1,1,3,3,5,5,7,7,9,9-Decamethylpentasiloxane

1,1,3,3,5,5,7,7,9,9-Decamethylpentasiloxane

C10H32O4Si5 (356.1146872)


   

Pyridine, 3-​bromo-​2-​(2,​5-​dimethyl-​1H-​pyrrol-​1-​yl)​-​5-​(phenylmethoxy)​-

Pyridine, 3-​bromo-​2-​(2,​5-​dimethyl-​1H-​pyrrol-​1-​yl)​-​5-​(phenylmethoxy)​-

C18H17BrN2O (356.0524172)


   

2,5-bis(diethoxyphosphoryl)thiophene

2,5-bis(diethoxyphosphoryl)thiophene

C12H22O6P2S (356.0612292)


   

(2-anilino-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone

(2-anilino-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone

C22H16N2OS (356.0983286)


   

Methyltriphenylphosphonium bromide

Methyltriphenylphosphonium bromide

C19H18BrP (356.0329418)


   

Benzyl 2-(6-fluoro-5-nitro-1H-indol-2-yl)-2-methylpropanoate

Benzyl 2-(6-fluoro-5-nitro-1H-indol-2-yl)-2-methylpropanoate

C19H17FN2O4 (356.11722940000004)


   

2-benzofuran-1,3-dione,ethane-1,2-diol,hexanedioic acid

2-benzofuran-1,3-dione,ethane-1,2-diol,hexanedioic acid

C16H20O9 (356.110727)


   

1,6-anhydro-3,4-o-isopropylidene-2-tosyl-b-d-galactopyranose

1,6-anhydro-3,4-o-isopropylidene-2-tosyl-b-d-galactopyranose

C16H20O7S (356.09296900000004)


   

tin (iv) isopropoxide

tin (iv) isopropoxide

C12H28O4Sn (356.1009478)


   

7,9-diphenyl-8H-cyclopenta[a]acenaphthylen-8-one

7,9-diphenyl-8H-cyclopenta[a]acenaphthylen-8-one

C27H16O (356.1201086)


   

Methanediol,1,1-bis(4-methylbenzenesulfonate)

Methanediol,1,1-bis(4-methylbenzenesulfonate)

C15H16O6S2 (356.0388276)


   

2-DIPHENYLPHOSPHINO-1-NAPHTHOIC ACID

2-DIPHENYLPHOSPHINO-1-NAPHTHOIC ACID

C23H17O2P (356.0966112)


   

Ferric acetylacetonate

Ferric acetylacetonate

C15H24FeO6 (356.0922194)


   

8,9,10,11,12,13,14,15-Octahydrodinaphtho[2,1-d:1,2-f][1,3,2]dio xaphosphepin-4-ol 4-oxide

8,9,10,11,12,13,14,15-Octahydrodinaphtho[2,1-d:1,2-f][1,3,2]dio xaphosphepin-4-ol 4-oxide

C20H21O4P (356.11773960000005)


   

1-CYCLOPROPYL-5-NITRO-6,7,8-TRIFLUORO-1,4-DIHYDRO-4-OXO-3- QUINOLINECARBOXYLIC ACID ETHYL ESTER

1-CYCLOPROPYL-5-NITRO-6,7,8-TRIFLUORO-1,4-DIHYDRO-4-OXO-3- QUINOLINECARBOXYLIC ACID ETHYL ESTER

C15H11F3N2O5 (356.0620032)


   

Pyrantel tartrate

Pyrantel tartrate

C15H20N2O6S (356.10420200000004)


D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent Pyrantel tartrate is an orally active anthelmintic and an agonist of the nicotinic acetylcholine receptor (nAChR). Pyrantel tartrate can cause spasmodic muscle paralysis in parasites. Pyrantel tartrate can be used in the study of parasitic infections such as ascariasis, hookworm infections, intestinal worms (pinworm infections), trichinosis and trichinosis[1][2].

   

PENTAMETHYL CYCLOPENTADIENE-1,2,3,4,5-PENTACARBOXYLATE

PENTAMETHYL CYCLOPENTADIENE-1,2,3,4,5-PENTACARBOXYLATE

C15H16O10 (356.0743436)


   

2-bromo-9,9-dibutyl-9H-fluorene

2-bromo-9,9-dibutyl-9H-fluorene

C21H25Br (356.113951)


   

Acetic acid,2-mercapto-, 1,1-[2-ethyl-2-[[(2-mercaptoacetyl)oxy]methyl]-1,3-propanediyl]ester

Acetic acid,2-mercapto-, 1,1-[2-ethyl-2-[[(2-mercaptoacetyl)oxy]methyl]-1,3-propanediyl]ester

C12H20O6S3 (356.04219800000004)


   

(5R)-3-{3-Fluoro-4-[6-(2H-tetrazol-5-yl)-3-pyridinyl]phenyl}-5-(hydroxymethyl)-1,3-oxazolidin-2-one

(5R)-3-{3-Fluoro-4-[6-(2H-tetrazol-5-yl)-3-pyridinyl]phenyl}-5-(hydroxymethyl)-1,3-oxazolidin-2-one

C16H13FN6O3 (356.10331199999996)


   

Difluoro(triphenylphosphonio)acetate

Difluoro(triphenylphosphonio)acetate

C20H15F2O2P (356.0777684)


   

AICAR phosphate

AICAR phosphate

C9H17N4O9P (356.07331220000003)


AICAR phosphate (Acadesine phosphate) is an adenosine analog and a AMPK activator. AICAR phosphate regulates the glucose and lipid metabolism, and inhibits proinflammatory cytokines and iNOS production. AICAR phosphate is also an autophagy, YAP and mitophagy inhibitor[1][2]. AICAR phosphate (Acadesine phosphate) is an adenosine analog and a AMPK activator. AICAR phosphate regulates the glucose and lipid metabolism, and inhibits proinflammatory cytokines and iNOS production. AICAR phosphate is also an autophagy, YAP and mitophagy inhibitor[1][2]. AICAR phosphate (Acadesine phosphate) is an adenosine analog and a AMPK activator. AICAR phosphate regulates the glucose and lipid metabolism, and inhibits proinflammatory cytokines and iNOS production. AICAR phosphate is also an autophagy, YAP and mitophagy inhibitor[1][2].

   

Benzoic acid, 4-methyl-, 4-oxo-2-phenyl-4H-1-benzopyran-3-yl ester

Benzoic acid, 4-methyl-, 4-oxo-2-phenyl-4H-1-benzopyran-3-yl ester

C23H16O4 (356.1048536)


   
   

1-(3-CHLOROPHENYL)-3-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)UREA

1-(3-CHLOROPHENYL)-3-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)UREA

C18H17ClN4O2 (356.1039972)


   

Tin(IV) isopropoxide isopropanol adduct

Tin(IV) isopropoxide isopropanol adduct

C12H28O4Sn (356.1009478)


   

Diazenecarbothioicacid, 2-(2-naphthalenyl)-, 2-(2-naphthalenyl)hydrazide

Diazenecarbothioicacid, 2-(2-naphthalenyl)-, 2-(2-naphthalenyl)hydrazide

C21H16N4S (356.1095616)


   

Diphenylmercury

Diphenylmercury

C12H10Hg (356.048878)


   

6-O-Feruloylglucose

6-O-Feruloylglucose

C16H20O9 (356.110727)


   

5-Methoxy-1,2-dimethyl-3-[(4-nitrophenoxy)methyl]indole-4,7-dione

5-Methoxy-1,2-dimethyl-3-[(4-nitrophenoxy)methyl]indole-4,7-dione

C18H16N2O6 (356.1008316)


   

Chlorisondamine

Chlorisondamine

C14H20Cl4N2+2 (356.03805200000005)


C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C66886 - Nicotinic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D005730 - Ganglionic Blockers D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018680 - Cholinergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents

   

methyl (4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

methyl (4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

C16H15F3N2O4 (356.0983866)


   

methyl (4R)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

methyl (4R)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

C16H15F3N2O4 (356.0983866)


D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents > D002120 - Calcium Channel Agonists D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators

   

3-O-beta-D-glucopyranuronosyl-beta-D-galactopyranose

3-O-beta-D-glucopyranuronosyl-beta-D-galactopyranose

C12H20O12 (356.09547200000003)


   

N4-Acetylsulfaphenazole

N4-Acetylsulfaphenazole

C17H16N4O3S (356.0943066)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

5-(3,4-dimethoxyphenyl)-3-(4-ethoxyphenyl)-1H-imidazole-2-thione

5-(3,4-dimethoxyphenyl)-3-(4-ethoxyphenyl)-1H-imidazole-2-thione

C19H20N2O3S (356.119457)


   

N4-(2-furanylmethyl)-N2-(3-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine

N4-(2-furanylmethyl)-N2-(3-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine

C16H16N6O4 (356.1232976)


   

3-(2-hydroxyphenyl)-2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinazolin-4(3H)-one

3-(2-hydroxyphenyl)-2-[(E)-2-(4-hydroxyphenyl)ethenyl]quinazolin-4(3H)-one

C22H16N2O3 (356.1160866)


   

Nalpha-Benzoyl-L-asparagine 4-nitroanilide

Nalpha-Benzoyl-L-asparagine 4-nitroanilide

C17H16N4O5 (356.1120646)


   

N-methyl-N-(4-methyl-2-thiazolyl)-2-[(6-phenyl-3-pyridazinyl)thio]acetamide

N-methyl-N-(4-methyl-2-thiazolyl)-2-[(6-phenyl-3-pyridazinyl)thio]acetamide

C17H16N4OS2 (356.07654859999997)


   

2-Methoxy-4-[3-(2-methoxyphenyl)-5,6-dihydro-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenol

2-Methoxy-4-[3-(2-methoxyphenyl)-5,6-dihydro-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenol

C17H16N4O3S (356.0943066)


   

4-(5,6-Dimethyl-1-benzimidazolyl)-5-phenylthieno[2,3-d]pyrimidine

4-(5,6-Dimethyl-1-benzimidazolyl)-5-phenylthieno[2,3-d]pyrimidine

C21H16N4S (356.1095616)


   

4-(2-methoxyphenoxy)-N-(3-pyridinyl)benzenesulfonamide

4-(2-methoxyphenoxy)-N-(3-pyridinyl)benzenesulfonamide

C18H16N2O4S (356.08307360000003)


   

3-[(4-Chloroanilino)methylidene]-2-(2-hydroxyethylimino)-9-methyl-4-pyrido[1,2-a]pyrimidinone

3-[(4-Chloroanilino)methylidene]-2-(2-hydroxyethylimino)-9-methyl-4-pyrido[1,2-a]pyrimidinone

C18H17ClN4O2 (356.1039972)


   

(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-(4-methoxyanilino)-1,3-thiazol-4-one

(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-(4-methoxyanilino)-1,3-thiazol-4-one

C18H16N2O4S (356.08307360000003)


   

1-(4-Morpholinyl)-2-[[3-(3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]ethanone

1-(4-Morpholinyl)-2-[[3-(3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]ethanone

C16H16N6O2S (356.1055396)


   

1-(4-Morpholinyl)-2-[[3-(2-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]ethanone

1-(4-Morpholinyl)-2-[[3-(2-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]ethanone

C16H16N6O2S (356.1055396)


   
   

Cysteine-Methylene-Carbamoyl-1,10-Phenanthroline

Cysteine-Methylene-Carbamoyl-1,10-Phenanthroline

C17H16N4O3S (356.0943066)


   

(2S)-2-{(R)-carboxy[(thiophen-2-ylacetyl)amino]methyl}-5-methyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid

(2S)-2-{(R)-carboxy[(thiophen-2-ylacetyl)amino]methyl}-5-methyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid

C14H16N2O5S2 (356.0500606)


   

{1-[(3-Hydroxy-methyl-5-phosphonooxy-methyl-pyridin-4-ylmethyl)-amino]-ethyl}-phosphonic acid

{1-[(3-Hydroxy-methyl-5-phosphonooxy-methyl-pyridin-4-ylmethyl)-amino]-ethyl}-phosphonic acid

C10H18N2O8P2 (356.0538368)


   

Apricoxib

Apricoxib

C19H20N2O3S (356.119457)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C80509 - COX-2 Inhibitor C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor

   

Gentiopicrin

(5R,6S)-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-5-vinyl-5,6-dihydro-3H-pyrano[5,4-c]pyran-1-one

C16H20O9 (356.110727)


Gentiopicroside, a naturally occurring iridoid glycoside, inhibits P450 activity, with an IC50 and a Ki of 61 μM and 22.8 μM for CYP2A6; Gentiopicroside has anti-inflammatoryand antioxidative effects. Gentiopicroside, a naturally occurring iridoid glycoside, inhibits P450 activity, with an IC50 and a Ki of 61 μM and 22.8 μM for CYP2A6; Gentiopicroside has anti-inflammatoryand antioxidative effects.

   

1-O-Feruloylglucose

3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

C16H20O9 (356.110727)


1-o-feruloylglucose is a member of the class of compounds known as hydroxycinnamic acid glycosides. Hydroxycinnamic acid glycosides are glycosylated hydoxycinnamic acids derivatives. 1-o-feruloylglucose is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 1-o-feruloylglucose can be found in green vegetables and root vegetables, which makes 1-o-feruloylglucose a potential biomarker for the consumption of these food products. 1-O-Feruloylglucose is found in green vegetables. 1-O-Feruloylglucose is present in Solanum, Raphanus, etc. species.

   
   

deacetoxycephalosporin C(1-)

deacetoxycephalosporin C(1-)

C14H18N3O6S- (356.09162680000003)


Conjugate base of deacetoxycephalosporin C

   

D-pantetheine 4-phosphate(2-)

D-pantetheine 4-phosphate(2-)

C11H21N2O7PS-2 (356.08070460000005)


COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   
   
   

Deoxyviolaceinate

Deoxyviolaceinate

C21H14N3O3- (356.1035114)


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

   
   
   

(3S,7R)-11-methoxy-3,7-dimethyl-6,8,16,20-tetraoxapentacyclo[10.8.0.02,9.03,7.013,18]icosa-1,4,9,11,13(18)-pentaene-17,19-dione

(3S,7R)-11-methoxy-3,7-dimethyl-6,8,16,20-tetraoxapentacyclo[10.8.0.02,9.03,7.013,18]icosa-1,4,9,11,13(18)-pentaene-17,19-dione

C19H16O7 (356.0895986)


   

(2S)-6-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1H-indole-2-carboxylate

(2S)-6-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1H-indole-2-carboxylate

C15H18NO9- (356.0981518)


   

6-O-(3-Methoxy-4-hydroxy-trans-cinnamoyl)-beta-D-glucopyranose

6-O-(3-Methoxy-4-hydroxy-trans-cinnamoyl)-beta-D-glucopyranose

C16H20O9 (356.110727)


   

coumaroyl(3-OMe)(-2)Glc

coumaroyl(3-OMe)(-2)Glc

C16H20O9 (356.110727)


   

Isoferulyl D-glucose ester

Isoferulyl D-glucose ester

C16H20O9 (356.110727)


   

2-Hydroxypropanoyl 2-hydroxy-2-[2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]propaneperoxoate

2-Hydroxypropanoyl 2-hydroxy-2-[2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]propaneperoxoate

C12H20O12 (356.09547200000003)


   

4-(3,4-Dihydroxyphenyl)-6-(3,4-dihydroxybenzylidene)-3-hydroxy-2H-pyran-2,5(6H)-dione

4-(3,4-Dihydroxyphenyl)-6-(3,4-dihydroxybenzylidene)-3-hydroxy-2H-pyran-2,5(6H)-dione

C18H12O8 (356.0532152)


   

4-(2,5-Dihydroxyphenyl)-6-(3,4-dihydroxybenzylidene)-3-hydroxy-2,5(6H)-pyrandione

4-(2,5-Dihydroxyphenyl)-6-(3,4-dihydroxybenzylidene)-3-hydroxy-2,5(6H)-pyrandione

C18H12O8 (356.0532152)


   

[3,4,5-Trihydroxy-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-2-yl] formate

[3,4,5-Trihydroxy-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-2-yl] formate

C12H20O12 (356.09547200000003)


   

3,5-Dihydroxycinnamic acid glucuronide

3,5-Dihydroxycinnamic acid glucuronide

C15H16O10 (356.0743436)


   

Methyl (2s)-4-Hydroxy-3-(4-Hydroxyphenyl)-2-[(4-Hydroxyphenyl)methyl]-5-Oxo-2,5-Dihydrofuran-2-Carboxylate

Methyl (2s)-4-Hydroxy-3-(4-Hydroxyphenyl)-2-[(4-Hydroxyphenyl)methyl]-5-Oxo-2,5-Dihydrofuran-2-Carboxylate

C19H16O7 (356.0895986)


   

2-beta-D-Glucopyranosyloxy-4-methoxy-cis-cinnamic acid

2-beta-D-Glucopyranosyloxy-4-methoxy-cis-cinnamic acid

C16H20O9 (356.110727)


   

Feruloyl glucose

Feruloyl glucose

C16H20O9 (356.110727)


   

2-[[2-(6-oxo-1-cyclohexa-2,4-dienylidene)-3H-1,3,4-oxadiazol-5-yl]thio]acetic acid (2,6-dimethylphenyl) ester

2-[[2-(6-oxo-1-cyclohexa-2,4-dienylidene)-3H-1,3,4-oxadiazol-5-yl]thio]acetic acid (2,6-dimethylphenyl) ester

C18H16N2O4S (356.08307360000003)


   

5-amino-2-(3-nitrophenyl)-1-phenyl-2H-pyrrole-3,3,4-tricarbonitrile

5-amino-2-(3-nitrophenyl)-1-phenyl-2H-pyrrole-3,3,4-tricarbonitrile

C19H12N6O2 (356.1021692)


   

N-[(5-chloro-8-hydroxy-7-quinolinyl)-(4-methoxyphenyl)methyl]acetamide

N-[(5-chloro-8-hydroxy-7-quinolinyl)-(4-methoxyphenyl)methyl]acetamide

C19H17ClN2O3 (356.09276420000003)


   

7-[[[1-(2-Methylphenyl)-5-tetrazolyl]thio]methyl]-5-thiazolo[3,2-a]pyrimidinone

7-[[[1-(2-Methylphenyl)-5-tetrazolyl]thio]methyl]-5-thiazolo[3,2-a]pyrimidinone

C15H12N6OS2 (356.0513982)


   

2-[(7-Chloro-4-quinazolinyl)oxy]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

2-[(7-Chloro-4-quinazolinyl)oxy]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

C18H13ClN2O4 (356.05638080000006)


   

3-Oxo-2-[(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)thio]butanoic acid ethyl ester

3-Oxo-2-[(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)thio]butanoic acid ethyl ester

C17H16N4O3S (356.0943066)


   

2-(1-Benzimidazolylmethyl)-5-[(4-chlorophenyl)methylthio]-1,3,4-oxadiazole

2-(1-Benzimidazolylmethyl)-5-[(4-chlorophenyl)methylthio]-1,3,4-oxadiazole

C17H13ClN4OS (356.04985580000005)


   

methyl 4-{[2-(methylsulfanyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]carbonyl}phenyl ether

methyl 4-{[2-(methylsulfanyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]carbonyl}phenyl ether

C18H16N2O4S (356.08307360000003)


   

5-Chloro-2-(3,5-dimethylphenyl)-4-(4-methoxyphenoxy)-3-pyridazinone

5-Chloro-2-(3,5-dimethylphenyl)-4-(4-methoxyphenoxy)-3-pyridazinone

C19H17ClN2O3 (356.09276420000003)


   

4-[({[3-(4-Methoxyphenyl)acryloyl]amino}carbonothioyl)amino]benzoic acid

4-[({[3-(4-Methoxyphenyl)acryloyl]amino}carbonothioyl)amino]benzoic acid

C18H16N2O4S (356.08307360000003)


   

5-(4-Hydroxy-3-methoxy-benzylidene)-2-(2-methoxy-phenylimino)-thiazolidin-4-one

5-(4-Hydroxy-3-methoxy-benzylidene)-2-(2-methoxy-phenylimino)-thiazolidin-4-one

C18H16N2O4S (356.08307360000003)


   

3-amino-2-cyano-5-(3-methoxyphenyl)-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester

3-amino-2-cyano-5-(3-methoxyphenyl)-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester

C17H16N4O3S (356.0943066)


   

3-[3-(2,4-Dichlorophenoxy)propoxy]-6-methyl-2-nitropyridine

3-[3-(2,4-Dichlorophenoxy)propoxy]-6-methyl-2-nitropyridine

C15H14Cl2N2O4 (356.0330584)


   

4-(2-oxo-1-benzopyran-3-yl)-N-(3-pyridinylmethyl)benzamide

4-(2-oxo-1-benzopyran-3-yl)-N-(3-pyridinylmethyl)benzamide

C22H16N2O3 (356.1160866)


   

[3-[4-Morpholinyl(sulfanylidene)methyl]-1-indolyl]-thiophen-2-ylmethanone

[3-[4-Morpholinyl(sulfanylidene)methyl]-1-indolyl]-thiophen-2-ylmethanone

C18H16N2O2S2 (356.06531559999996)


   

5-Chloro-4-(4-ethoxyphenoxy)-2-(4-methylphenyl)-3-pyridazinone

5-Chloro-4-(4-ethoxyphenoxy)-2-(4-methylphenyl)-3-pyridazinone

C19H17ClN2O3 (356.09276420000003)


   

5-Chloro-2-(4-ethylphenyl)-4-(4-methoxyphenoxy)-3-pyridazinone

5-Chloro-2-(4-ethylphenyl)-4-(4-methoxyphenoxy)-3-pyridazinone

C19H17ClN2O3 (356.09276420000003)


   

2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-7H-pyrano[2,3-g][1,4]benzodioxin-7-one

2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-7H-pyrano[2,3-g][1,4]benzodioxin-7-one

C19H16O7 (356.0895986)


A guaiacyl lignin obtained by formal cyclocodensation between guaiacylglycerol and esculetin. It is found in Arabidopsis thaliana.

   

2-(1,3-Benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]-5-methyl-3-pyrazolamine

2-(1,3-Benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]-5-methyl-3-pyrazolamine

C17H13FN4S2 (356.056563)


   

5-(4-Methoxyphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine

5-(4-Methoxyphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine

C15H12N6OS2 (356.0513982)


   

N-(2-methoxyphenyl)-3-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]propanamide

N-(2-methoxyphenyl)-3-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]propanamide

C17H16N4O3S (356.0943066)


   

N-[3-(3-chlorophenyl)-5-isoxazolyl]-2-(4,5,6,7-tetrahydroindazol-2-yl)acetamide

N-[3-(3-chlorophenyl)-5-isoxazolyl]-2-(4,5,6,7-tetrahydroindazol-2-yl)acetamide

C18H17ClN4O2 (356.1039972)


   

4-Methyl-5-thieno[3,2-b]pyrrolecarboxylic acid [1-oxo-1-(2-phenylethylamino)propan-2-yl] ester

4-Methyl-5-thieno[3,2-b]pyrrolecarboxylic acid [1-oxo-1-(2-phenylethylamino)propan-2-yl] ester

C19H20N2O3S (356.119457)


   
   

5-(2-Methoxyphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine

5-(2-Methoxyphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine

C15H12N6OS2 (356.0513982)


   

5-(3-Methoxyphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine

5-(3-Methoxyphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine

C15H12N6OS2 (356.0513982)


   

2-[2-(3,4-Dihydroxy-phenyl)-vinyl]-3-phenyl-3H-quinazolin-4-one

2-[2-(3,4-Dihydroxy-phenyl)-vinyl]-3-phenyl-3H-quinazolin-4-one

C22H16N2O3 (356.1160866)


   

6-O-(trans-feruloyl)-D-galactopyranose

6-O-(trans-feruloyl)-D-galactopyranose

C16H20O9 (356.110727)


   

3-O-beta-D-glucosyl-D-glucuronic acid

3-O-beta-D-glucosyl-D-glucuronic acid

C12H20O12 (356.09547200000003)


   

2-(3,3-dimethyl-2-oxobutyl)sulfanyl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

2-(3,3-dimethyl-2-oxobutyl)sulfanyl-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

C19H20N2OS2 (356.101699)


   

(3,4,5,6-Tetrahydroxyoxan-2-yl)methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

(3,4,5,6-Tetrahydroxyoxan-2-yl)methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C16H20O9 (356.110727)


   

Ferulic acid O-glucoside

Ferulic acid O-glucoside

C16H20O9 (356.110727)


   

11-hydroxy-O-methyldihydrosterigmatocystin

11-hydroxy-O-methyldihydrosterigmatocystin

C19H16O7 (356.0895986)


A sterigmatocystin that is the 11-hydroxy-8-O-methyl derivative of dihydrosterigmatocystin.

   

(E)-Ferulic acid 4-O-beta-D-glucoside

(E)-Ferulic acid 4-O-beta-D-glucoside

C16H20O9 (356.110727)


   

2-(1H-benzimidazol-2-yl)-3-oxo-4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]butanenitrile

2-(1H-benzimidazol-2-yl)-3-oxo-4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]butanenitrile

C16H16N6O2S (356.1055396)


   

3,4,5-Trihydroxy-6-[[3-(4-methoxyphenyl)oxiran-2-yl]methoxy]oxane-2-carboxylic acid

3,4,5-Trihydroxy-6-[[3-(4-methoxyphenyl)oxiran-2-yl]methoxy]oxane-2-carboxylic acid

C16H20O9 (356.110727)


   

3,4,5-Trihydroxy-6-[[2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy]oxane-2-carboxylic acid

3,4,5-Trihydroxy-6-[[2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy]oxane-2-carboxylic acid

C12H20O12 (356.09547200000003)


   

4-acetamido-3-methoxyphenyl beta-D-glucopyranosiduronate

4-acetamido-3-methoxyphenyl beta-D-glucopyranosiduronate

C15H18NO9- (356.0981518)


   

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

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

C15H16O8S (356.0565856)


   

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

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

C16H20O9 (356.110727)


   

2-(4-Methoxyphenyl)imino-4-(4-nitrophenyl)-4-oxobutanoic acid methyl ester

2-(4-Methoxyphenyl)imino-4-(4-nitrophenyl)-4-oxobutanoic acid methyl ester

C18H16N2O6 (356.1008316)


   

[3-Hydroxy-4-(7-methoxy-2-oxochromen-8-yl)-2-methylidenebutyl] hydrogen sulate

[3-Hydroxy-4-(7-methoxy-2-oxochromen-8-yl)-2-methylidenebutyl] hydrogen sulate

C15H16O8S (356.0565856)


   

3,4,5-Trihydroxy-6-(5-hydroxy-2-methoxy-4-prop-2-enylphenoxy)oxane-2-carboxylic acid

3,4,5-Trihydroxy-6-(5-hydroxy-2-methoxy-4-prop-2-enylphenoxy)oxane-2-carboxylic acid

C16H20O9 (356.110727)


   

(E)-3-[4-methoxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

(E)-3-[4-methoxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid

C16H20O9 (356.110727)


   

Cobalt triacetylatonate

Cobalt triacetylatonate

C15H21CoO6 (356.0670046)


   

2-Hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid

2-Hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid

C16H20O7S (356.09296900000004)


   

1-Feruloyl-D-glucose

(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 3-(4-hydroxy-3-methoxyphenyl)acrylate

C16H20O9 (356.110727)


1-O-feruloyl-beta-D-glucose is a beta-D-glucoside resulting from the formal condensation of the carboxy group of ferulic acid with the anomeric hydroxy group of beta-D-glucose. It has a role as an antioxidant and a plant metabolite. It is a beta-D-glucoside, a cinnamate ester, a member of phenols and an aromatic ether. It is functionally related to a ferulic acid. 1-O-feruloyl-beta-D-glucose is a natural product found in Balanophora japonica, Linaria japonica, and other organisms with data available. A beta-D-glucoside resulting from the formal condensation of the carboxy group of ferulic acid with the anomeric hydroxy group of beta-D-glucose.

   

5-Amino-6-(5-phospho-D-ribitylamino)uracil

5-Amino-6-(5-phospho-D-ribitylamino)uracil

C9H17N4O9P (356.07331220000003)


5-O-Phosphono-D-ribitol in which the hydroxy group at position 1 is substituted by the 6-amino group of 5,6-diaminopyrimidine-2,4(1H,3H)-dione.

   

Laquinimod

Laquinimod

C19H17ClN2O3 (356.09276420000003)


C308 - Immunotherapeutic Agent N - Nervous system

   

D-pantetheine 4-phosphate(2-)

D-pantetheine 4-phosphate(2-)

C11H21N2O7PS (356.08070460000005)


Pantetheine 4-phosphate(2-) with D (R) configuration at the 2 position. The dianion formed from D-pantetheine 4-phosphate by deprotonation of the phosphate group; major microspecies at pH 7.3.

   

Bay K-8644

Methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

C16H15F3N2O4 (356.0983866)


D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents > D002120 - Calcium Channel Agonists D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators

   
   
   

2-O-beta-D-Glucopyranuronosyl-D-mannose

2-O-beta-D-Glucopyranuronosyl-D-mannose

C12H20O12 (356.09547200000003)


   

3-O-beta-D-Galactopyranuronosyl-D-galactose

3-O-beta-D-Galactopyranuronosyl-D-galactose

C12H20O12 (356.09547200000003)


   

1-O-2-Hydroxy-4-methoxycinnamoyl-b-D-glucose

1-O-2-Hydroxy-4-methoxycinnamoyl-b-D-glucose

C16H20O9 (356.110727)


   

4-O-alpha-D-Glucopyranuronosyl-D-galactose

4-O-alpha-D-Glucopyranuronosyl-D-galactose

C12H20O12 (356.09547200000003)


   

2-methoxyacetaminophen glucuronide(1-)

2-methoxyacetaminophen glucuronide(1-)

C15H18NO9 (356.0981518)


A beta-D-glucosiduronate that is the conjugate base of 2-methoxyacetaminophen glucuronide, obtained by deprotonation of the carboxy group; major species at pH 7.3.

   
   

alpha-Ribazole 5-phosphate(2-)

alpha-Ribazole 5-phosphate(2-)

C14H17N2O7P (356.07733420000005)


Dianion of alpha-ribazole 5-phosphate arising from deprotonation of the phosphate OH groups; major species at pH 7.3.

   
   

Hydroxydimethoxymethylenedioxycoumestan

Hydroxydimethoxymethylenedioxycoumestan

C18H12O8 (356.0532152)


   

Desformylflustrabromine hydrochloride

Desformylflustrabromine hydrochloride

C16H22BrClN2 (356.06547820000003)


Desformylflustrabromine hydrochloride is a selective agonist of α4β2 neuronal nicotinic acetylcholine receptor (nAChR) with a pEC50 of 6.48.

   

Encenicline hydrochloride

Encenicline hydrochloride

C16H18Cl2N2OS (356.05168380000003)


Encenicline hydrochloride (EVP-6124 hydrochloride) is a novel partial agonist of α7 neuronal nicotinic acetylcholine receptors (nAChRs).