Exact Mass: 356.1096

Exact Mass Matches: 356.1096

Found 179 metabolites which its exact mass value is equals to given mass value 356.1096, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 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 (356.1107)


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 (356.1107)


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 (356.1195)


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].

   

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 (356.1107)


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 (356.1107)


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

   

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 (356.1107)


   

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 (356.1107)


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.

   

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 (356.1107)


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.

   

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 (356.1195)


   

Apricoxib

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

C19H20N2O3S (356.1195)


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 (356.1107)


   

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

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

C17H16N4O5 (356.1121)


   

Cyclohexyl-[cyclohexyl(sulfo)amino]sulfamic acid

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

C12H24N2O6S2 (356.1076)


   

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 (356.1107)


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 (356.1107)


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.

   

trans-p-feruloyl-beta-D-glucopyranoside

trans-p-feruloyl-beta-D-glucopyranoside

C16H20O9 (356.1107)


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

   

Juglanoside D

Juglanoside D

C16H20O9 (356.1107)


   
   

1-O-Feruloyl-beta-D-glucopyranose

1-O-Feruloyl-beta-D-glucopyranose

C16H20O9 (356.1107)


   

Juglanoside E

Juglanoside E

C16H20O9 (356.1107)


   

Arctodecurrolide

Arctodecurrolide

C17H21ClO6 (356.1027)


   

Ferulic acid 4-O-beta-glucopyranoside

Ferulic acid 4-O-beta-glucopyranoside

C16H20O9 (356.1107)


   

(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 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

(Z)-methyl lespedezate

(Z)-methyl lespedezate

C16H20O9 (356.1107)


   

Ferulic acid O-hexoside

Ferulic acid O-hexoside

C16H20O9 (356.1107)


   

1-O-caffeoyl-beta-D-glucose

1-O-caffeoyl-beta-D-glucose

C16H20O9 (356.1107)


   

Gentiopicrosid|Kautaurin

Gentiopicrosid|Kautaurin

C16H20O9 (356.1107)


   

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 (356.1027)


   

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 (356.1027)


   

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

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

C16H20O9 (356.1107)


   

Russupteridin-gelb I

Russupteridin-gelb I

C12H16N6O7 (356.108)


   

tri-O-methylnorbergenin

tri-O-methylnorbergenin

C16H20O9 (356.1107)


   
   

(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 (356.1042)


   

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 (356.1107)


   

Homofascaplysin B-1

Homofascaplysin B-1

C22H16N2O3 (356.1161)


   

[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 (356.1107)


   

Russupteridine yellow I

Russupteridine yellow I

C12H16N6O7 (356.108)


   

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 (356.1107)


   

radiatinoside

radiatinoside

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

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 (356.1107)


   

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 (356.1107)


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 (356.1107)


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

   

Pioglitazone

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

C19H20N2O3S (356.1195)


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 (356.1107)


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.

   

(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 (356.1107)


   

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 (356.1107)


   

(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 (356.1107)


   

Feruloyl Hexoside (isomer of 847)

Feruloyl Hexoside (isomer of 847)

C16H20O9 (356.1107)


Annotation level-3

   

Feruloyl Hexoside (isomer of 849)

Feruloyl Hexoside (isomer of 849)

C16H20O9 (356.1107)


Annotation level-3

   

(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 (356.1107)


   

N-Dealkylzuclopenthixol

N-Dealkylzuclopenthixol

C20H21ClN2S (356.1114)


   

Met-Val-OH

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

C15H20N2O6S (356.1042)


   

Val-Met-OH

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

C15H20N2O6S (356.1042)


   

1-O-Feruloylglucose

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

C16H20O9 (356.1107)


   

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 (356.1107)


   

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 (356.1107)


   

2-Glucosyloxy-4-methoxycinnamic acid

2-Glucosyloxy-4-methoxycinnamic acid

C16H20O9 (356.1107)


   

Minocromil

Minocromil

C18H16N2O6 (356.1008)


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

   

succinimidyl 4-(p-maleimidophenyl)butyrate

succinimidyl 4-(p-maleimidophenyl)butyrate

C18H16N2O6 (356.1008)


   

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

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

C17H25I (356.1001)


   

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

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

C17H16N4O5 (356.1121)


   
   

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

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

C19H17FN2O4 (356.1172)


   

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

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

C17H25I (356.1001)


   

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

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

C10H32O4Si5 (356.1147)


   

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 (356.1172)


   

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

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

C16H20O9 (356.1107)


   

tin (iv) isopropoxide

tin (iv) isopropoxide

C12H28O4Sn (356.1009)


   

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 (356.1177)


   

Pyrantel tartrate

Pyrantel tartrate

C15H20N2O6S (356.1042)


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].

   

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

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

C21H25Br (356.114)


   

(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 (356.1033)


   

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 (356.1049)


   

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 (356.104)


   

Tin(IV) isopropoxide isopropanol adduct

Tin(IV) isopropoxide isopropanol adduct

C12H28O4Sn (356.1009)


   

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

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

C21H16N4S (356.1096)


   

6-O-Feruloylglucose

6-O-Feruloylglucose

C16H20O9 (356.1107)


   

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 (356.1008)


   

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

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

C19H20N2O3S (356.1195)


   

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 (356.1161)


   

Nalpha-Benzoyl-L-asparagine 4-nitroanilide

Nalpha-Benzoyl-L-asparagine 4-nitroanilide

C17H16N4O5 (356.1121)


   

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 (356.1096)


   

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 (356.104)


   

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 (356.1055)


   

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 (356.1055)


   

Apricoxib

Apricoxib

C19H20N2O3S (356.1195)


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 (356.1107)


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 (356.1107)


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.

   

Protoviolaceinate

Protoviolaceinate

C21H14N3O3- (356.1035)


   

Deoxyviolaceinate

Deoxyviolaceinate

C21H14N3O3- (356.1035)


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.

   

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

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

C16H20O9 (356.1107)


   

coumaroyl(3-OMe)(-2)Glc

coumaroyl(3-OMe)(-2)Glc

C16H20O9 (356.1107)


   

Isoferulyl D-glucose ester

Isoferulyl D-glucose ester

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

Feruloyl glucose

Feruloyl glucose

C16H20O9 (356.1107)


   

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 (356.1022)


   

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

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

C22H16N2O3 (356.1161)


   

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 (356.104)


   

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 (356.1195)


   
   

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 (356.1161)


   

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

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

C16H20O9 (356.1107)


   

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 (356.1017)


   

(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 (356.1107)


   

Ferulic acid O-glucoside

Ferulic acid O-glucoside

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

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 (356.1055)


   

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 (356.1107)


   

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 (356.1107)


   

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 (356.1008)


   

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 (356.1107)


   

(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 (356.1107)


   

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 (356.1107)


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.

   

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

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

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

(2e)-3-(4-methoxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

(2e)-3-(4-methoxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

C16H20O9 (356.1107)


   

(2e)-3-(4-methoxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

(2e)-3-(4-methoxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

C16H20O9 (356.1107)


   

n-[1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

n-[1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

C18H16N2O6 (356.1008)


   

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

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

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

methyl 3-(4-hydroxyphenyl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}prop-2-enoate

methyl 3-(4-hydroxyphenyl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}prop-2-enoate

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

(3r)-8-hydroxy-3-methyl-5-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2-benzopyran-1-one

(3r)-8-hydroxy-3-methyl-5-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2-benzopyran-1-one

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

1-o-feruloyl-β-glucose

NA

C16H20O9 (356.1107)


{"Ingredient_id": "HBIN002904","Ingredient_name": "1-o-feruloyl-\u03b2-glucose","Alias": "NA","Ingredient_formula": "C16H20O9","Ingredient_Smile": "COC1=C(C=CC(=C1)C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7773","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

5-hydroxy-6-methylchromone-7-o-β-d-gluco-side

NA

C16H20O9 (356.1107)


{"Ingredient_id": "HBIN011632","Ingredient_name": "5-hydroxy-6-methylchromone-7-o-\u03b2-d-gluco-side","Alias": "NA","Ingredient_formula": "C16H20O9","Ingredient_Smile": "CC1=C(C=C2C(=C1O)C(=O)CCO2)OC3C(C(C(C(O3)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10480","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

6-o-feruloyl-β-d-glucopyranoside

NA

C16H20O9 (356.1107)


{"Ingredient_id": "HBIN012680","Ingredient_name": "6-o-feruloyl-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C16H20O9","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7772","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   
   

n-[(1z,3z)-1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

n-[(1z,3z)-1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

C18H16N2O6 (356.1008)


   

methyl (1's,2'r,3r,7'r,8'r,11'r)-5',7',11'-trihydroxy-2'-methyl-4,10'-dioxo-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-7'-carboxylate

methyl (1's,2'r,3r,7'r,8'r,11'r)-5',7',11'-trihydroxy-2'-methyl-4,10'-dioxo-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-7'-carboxylate

C16H20O9 (356.1107)


   

methyl (2z)-3-(4-hydroxyphenyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}prop-2-enoate

methyl (2z)-3-(4-hydroxyphenyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}prop-2-enoate

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

(1e,5r,6s,7r,8r)-5,6,7,8,9-pentahydroxy-1-(4-hydroxy-3-methoxyphenyl)(1-²h)non-1-ene-3,4-dione

(1e,5r,6s,7r,8r)-5,6,7,8,9-pentahydroxy-1-(4-hydroxy-3-methoxyphenyl)(1-²h)non-1-ene-3,4-dione

C16H20O9 (356.1107)


   

(3ar,4s,6as,8s,9s,9ar,9bs)-8-chloro-6a,9-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate

(3ar,4s,6as,8s,9s,9ar,9bs)-8-chloro-6a,9-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate

C17H21ClO6 (356.1027)


   

(3r)-8-hydroxy-3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2-benzopyran-1-one

(3r)-8-hydroxy-3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2-benzopyran-1-one

C16H20O9 (356.1107)


   

(1s,2r,3r,4ar,9ar,10s)-1,2,3,4a,8,9a,10-heptahydroxy-6-methoxy-3-methyl-1,2,4,10-tetrahydroanthracen-9-one

(1s,2r,3r,4ar,9ar,10s)-1,2,3,4a,8,9a,10-heptahydroxy-6-methoxy-3-methyl-1,2,4,10-tetrahydroanthracen-9-one

C16H20O9 (356.1107)


   

methyl (1's,2's,3r,5'r,7'r,8'r,11'r)-5',7',11'-trihydroxy-2'-methyl-4,10'-dioxo-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-7'-carboxylate

methyl (1's,2's,3r,5'r,7'r,8'r,11'r)-5',7',11'-trihydroxy-2'-methyl-4,10'-dioxo-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-7'-carboxylate

C16H20O9 (356.1107)


   

1-(7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2h-1,3-benzodioxol-5-yl)propan-1-one

1-(7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2h-1,3-benzodioxol-5-yl)propan-1-one

C16H20O9 (356.1107)


   

[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl (2z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl (2z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C16H20O9 (356.1107)


   

4,8-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

4,8-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

methyl (1's,2'r,3r,5'r,7'r,8'r,11'r)-5',7',11'-trihydroxy-2'-methyl-4,10'-dioxo-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-7'-carboxylate

methyl (1's,2'r,3r,5'r,7'r,8'r,11'r)-5',7',11'-trihydroxy-2'-methyl-4,10'-dioxo-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.0¹,⁵]dodecane]-7'-carboxylate

C16H20O9 (356.1107)


   

methyl 3-(3-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

methyl 3-(3-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

C16H20O9 (356.1107)


   

3,13,16,26-tetraazaheptacyclo[13.11.1.1²,¹⁰.0⁴,⁹.0¹⁹,²⁷.0²⁰,²⁵.0¹⁴,²⁸]octacosa-1(27),2,4(9),5,7,10(28),11,13,15,17,19,21,23,25-tetradecaene

3,13,16,26-tetraazaheptacyclo[13.11.1.1²,¹⁰.0⁴,⁹.0¹⁹,²⁷.0²⁰,²⁵.0¹⁴,²⁸]octacosa-1(27),2,4(9),5,7,10(28),11,13,15,17,19,21,23,25-tetradecaene

C24H12N4 (356.1062)


   

n-[(7e)-2,4-dihydroxy-6-imino-8-(2,3,4,5-tetrahydroxypentyl)-5h-pteridin-7-ylidene]formamide

n-[(7e)-2,4-dihydroxy-6-imino-8-(2,3,4,5-tetrahydroxypentyl)-5h-pteridin-7-ylidene]formamide

C12H16N6O7 (356.108)


   

8-chloro-6a,9-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate

8-chloro-6a,9-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate

C17H21ClO6 (356.1027)


   

5,8-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

5,8-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

C16H20O9 (356.1107)


   

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

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

C16H20O9 (356.1107)


   

methyl (2e)-3-(3-hydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

methyl (2e)-3-(3-hydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

C16H20O9 (356.1107)


   

n-[(1z,3e)-1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

n-[(1z,3e)-1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

C18H16N2O6 (356.1008)


   

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

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

C16H20O9 (356.1107)


   

[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C16H20O9 (356.1107)


   

(2z)-3-(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

(2z)-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 (356.1107)


   

(1e,5r,6s,7r,8r)-5,6,7,8,9-pentahydroxy-1-(4-hydroxy-3-methoxyphenyl)non-1-ene-3,4-dione

(1e,5r,6s,7r,8r)-5,6,7,8,9-pentahydroxy-1-(4-hydroxy-3-methoxyphenyl)non-1-ene-3,4-dione

C16H20O9 (356.1107)


   

methyl (2e)-3-(3-hydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

methyl (2e)-3-(3-hydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

C16H20O9 (356.1107)


   

8-chloro-6a,9-dihydroxy-9-methyl-3,6-dimethylidene-2-oxo-hexahydro-3ah-azuleno[4,5-b]furan-4-yl acetate

8-chloro-6a,9-dihydroxy-9-methyl-3,6-dimethylidene-2-oxo-hexahydro-3ah-azuleno[4,5-b]furan-4-yl acetate

C17H21ClO6 (356.1027)


   

(2r,3r)-4-(acetyloxy)-2,3-dihydroxybutyl (2e)-3-(4-methoxy-6-oxopyran-2-yl)but-2-enoate

(2r,3r)-4-(acetyloxy)-2,3-dihydroxybutyl (2e)-3-(4-methoxy-6-oxopyran-2-yl)but-2-enoate

C16H20O9 (356.1107)


   

(3ar,4s,6as,8r,9r,9ar,9bs)-8-chloro-6a,9-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate

(3ar,4s,6as,8r,9r,9ar,9bs)-8-chloro-6a,9-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate

C17H21ClO6 (356.1027)


   

8-(chloromethyl)-4a,8-dihydroxy-3,5-dimethylidene-2-oxo-hexahydro-3ah-azuleno[6,5-b]furan-6-yl acetate

8-(chloromethyl)-4a,8-dihydroxy-3,5-dimethylidene-2-oxo-hexahydro-3ah-azuleno[6,5-b]furan-6-yl acetate

C17H21ClO6 (356.1027)


   

2-amino-4-[(1-carboxy-2-phenylmethanesulfinylethyl)-c-hydroxycarbonimidoyl]butanoic acid

2-amino-4-[(1-carboxy-2-phenylmethanesulfinylethyl)-c-hydroxycarbonimidoyl]butanoic acid

C15H20N2O6S (356.1042)


   

(4s)-4,8-dihydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

(4s)-4,8-dihydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

C16H20O9 (356.1107)


   

[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C16H20O9 (356.1107)


   

3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 3-(3,4-dihydroxyphenyl)-2-methylprop-2-enoate

3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 3-(3,4-dihydroxyphenyl)-2-methylprop-2-enoate

C16H20O9 (356.1107)


   

n-[(3z)-1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

n-[(3z)-1,4-bis(3,4-dihydroxyphenyl)-3-[(hydroxymethylidene)amino]buta-1,3-dien-2-yl]carboximidic acid

C18H16N2O6 (356.1008)


   

(2s)-2-amino-4-{[(1r)-1-carboxy-2-[(r)-phenylmethanesulfinyl]ethyl]-c-hydroxycarbonimidoyl}butanoic acid

(2s)-2-amino-4-{[(1r)-1-carboxy-2-[(r)-phenylmethanesulfinyl]ethyl]-c-hydroxycarbonimidoyl}butanoic acid

C15H20N2O6S (356.1042)


   

(2z)-3-(4-methoxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

(2z)-3-(4-methoxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

C16H20O9 (356.1107)


   

methyl 3-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

methyl 3-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

C16H20O9 (356.1107)


   

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2e)-3-(3,4-dihydroxyphenyl)-2-methylprop-2-enoate

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2e)-3-(3,4-dihydroxyphenyl)-2-methylprop-2-enoate

C16H20O9 (356.1107)


   

(4s)-5,8-dihydroxy-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

(4s)-5,8-dihydroxy-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one

C16H20O9 (356.1107)


   

n-[(7e)-2,4-dihydroxy-6-imino-8-[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]-5h-pteridin-7-ylidene]formamide

n-[(7e)-2,4-dihydroxy-6-imino-8-[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]-5h-pteridin-7-ylidene]formamide

C12H16N6O7 (356.108)


   

(3ar,4s,6as,8s,9s,9ar,9bs)-8-chloro-6a,9-dihydroxy-9-methyl-3,6-dimethylidene-2-oxo-hexahydro-3ah-azuleno[4,5-b]furan-4-yl acetate

(3ar,4s,6as,8s,9s,9ar,9bs)-8-chloro-6a,9-dihydroxy-9-methyl-3,6-dimethylidene-2-oxo-hexahydro-3ah-azuleno[4,5-b]furan-4-yl acetate

C17H21ClO6 (356.1027)


   

4-(acetyloxy)-2,3-dihydroxybutyl 3-(4-methoxy-6-oxopyran-2-yl)but-2-enoate

4-(acetyloxy)-2,3-dihydroxybutyl 3-(4-methoxy-6-oxopyran-2-yl)but-2-enoate

C16H20O9 (356.1107)


   

8-hydroxy-3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2-benzopyran-1-one

8-hydroxy-3-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2-benzopyran-1-one

C16H20O9 (356.1107)