Exact Mass: 712.2564906

Exact Mass Matches: 712.2564906

Found 42 metabolites which its exact mass value is equals to given mass value 712.2564906, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

(-)-Syringaresnol 4-O-β-D-apiofuranosyl-(1→2)-β-D-glucopyranoside

C33H44O17 (712.2578374)

(-)-Syringaresnol-4-O-β-D-apiofuranosyl-(1→2)-β-D-glucopyranoside is isolated from the bark of Albizia julibrissin[1]. (-)-Syringaresnol-4-O-β-D-apiofuranosyl-(1→2)-β-D-glucopyranoside is isolated from the bark of Albizia julibrissin[1]. (-)-Syringaresnol-4-O-β-D-apiofuranosyl-(1→2)-β-D-glucopyranoside is isolated from the bark of Albizia julibrissin[1]. (-)-Syringaresnol-4-O-β-D-apiofuranosyl-(1→2)-β-D-glucopyranoside is isolated from the bark of Albizia julibrissin[1].

Boehmenan

C40H40O12 (712.251964)

A natural product found particularly in Durio oxleyanus and Helicteres hirsuta.

SCHEMBL16363000

C40H40O12 (712.251964)

(+)-medioresinol 4,4-O-di-beta-D-glucopyranoside|(+)-medioresinol di-O-beta-D-glucopyranoside|(+)-medioresinol-di-O-beta-D-glucopyranoside|(+)-Medioresinol-di-O-beta-D-glucoside|medioresinol di-O-beta-D-glucopyranoside

(+)-medioresinol 4,4-O-di-beta-D-glucopyranoside|(+)-medioresinol di-O-beta-D-glucopyranoside|(+)-medioresinol-di-O-beta-D-glucopyranoside|(+)-Medioresinol-di-O-beta-D-glucoside|medioresinol di-O-beta-D-glucopyranoside

C33H44O17 (712.2578374)

Syringaresinol-4-O-??-D-apiofuranosyl-(1鈥樏傗垎2)-??-D-glucopyranoside

C33H44O17 (712.2578374)

(+)-medioresinol di-O-beta-D-glucopyranoside

C33H44O17 (712.2578374)

4-O-(6-O-beta-D-apiofuranosyl-beta-D-glucopyranosyl)-(+)-(7S,7S,8R,8R)-4-hydroxy-3,3,5,5-tetramethoxy-7,9:7,9-diepoxylignane|obtusifoside A

C33H44O17 (712.2578374)

bis<4-(beta-D-glucopyranosyloxy)benzyl> (S)-(-)-2-isopropylmalate|bis[4-(beta-D-glucopyranosyloxy)benzyl] (S)-(-)-2-isopropylmalate

C33H44O17 (712.2578374)

Trachelogenin 4-O-β-gentiobioside

Trachelogenin 4 inverted exclamation marka-O-|A-gentiobioside

C33H44O17 (712.2578374)

Trachelogenin 4-O-beta-gentiobioside is a natural product found in Trachelospermum asiaticum and Trachelospermum jasminoides with data available.

(+)-Medioresinol Di-O-β-D-glucopyranoside

(2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6R,6aS)-6-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C33H44O17 (712.2578374)

(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-[(3R,6S)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol

NCGC00385303-01!(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-[(3R,6S)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol

C33H44O17 (712.2578374)

pyl ester, (2E)-

3-[2-(4-hydroxy-3-methoxyphenyl)-3-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C40H40O12 (712.251964)

N,N-Bis({(5S)-2-oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-1,3-oxazolidin-5-yl}methyl)phthalamide

C36H36N6O10 (712.2492796)

Casopitant mesylate

C31H39F7N4O5S (712.2529248)

D018377 - Neurotransmitter Agents > D064729 - Neurokinin-1 Receptor Antagonists D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent D005765 - Gastrointestinal Agents > D000932 - Antiemetics D002491 - Central Nervous System Agents Casopitant mesylate (GW679769B) is a potent, selective, brain permeable and orally active neurokinin 1 (NK1) receptor antagonist. Casopitant mesylate is a second in the class of antiemetics that acts to antagonise the emetogenic effect of substance P. Casopitant mesylate is also a substrate and a weak-to-moderate inhibitor of CYP3A4. Casopitant mesylate can be used for chemotherapy-induced nausea and vomiting (CINV) and postoperative nausea and vomiting (PONV)[1][2].

L-Glutamic acid, N-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-L-gamma-glutamyl-L-gamma-glutamyl-

C30H36N10O11 (712.2564906)

(1E,4E)-4-{[4-(Dimethylamino)phenyl](4-{ethyl[(3-sulfophenyl)methyl]amino}phenyl)methylidene}-N-ethyl-N-[(3-sulfophenyl)methyl]cyclohexa-2,5-dien-1-iminium

C39H42N3O6S2+ (712.2514892000002)

2-[5-[6-[3,5-Dimethoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C33H44O17 (712.2578374)

[4-[[4-[Ethyl-[(3-sulfophenyl)methyl]amino]phenyl]-[4-[ethyl-[(4-sulfophenyl)methyl]amino]phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium

C39H42N3O6S2+ (712.2514892000002)

(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-[(3R,6S)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol

(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-[(3R,6S)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol

C33H44O17 (712.2578374)

2-{2,6-dimethoxy-4-[4-(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C33H44O17 (712.2578374)

(2s)-2-hydroxy-2-isopropyl-3,3-bis[(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl]butanedioic acid

C33H44O17 (712.2578374)

2-{2,6-dimethoxy-4-[4-(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenoxy}-6-methoxyoxane-3,4,5-triol

C33H44O17 (712.2578374)

(3s,4s)-4-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}phenyl)methyl]oxolan-2-one

(3s,4s)-4-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}phenyl)methyl]oxolan-2-one

C33H44O17 (712.2578374)

[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-5-(3-{[(2z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C40H40O12 (712.251964)

(2s)-6-[(1r,5s,6r)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-(4-hydroxy-4-methylpentyl)cyclohex-2-en-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

C40H40O12 (712.251964)

(2r,3r,4s,5s,6s)-2-{4-[(1s,3ar,4s,6ar)-4-(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-6-methoxyoxane-3,4,5-triol

(2r,3r,4s,5s,6s)-2-{4-[(1s,3ar,4s,6ar)-4-(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-6-methoxyoxane-3,4,5-triol

C33H44O17 (712.2578374)

[(2r,3s)-2-(4-hydroxy-3-methoxyphenyl)-5-(3-{[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C40H40O12 (712.251964)

(2s,3r,4s,5s,6r)-2-{4-[(1s,3ar,4s,6ar)-4-(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2s,3r,4s,5s,6r)-2-{4-[(1s,3ar,4s,6ar)-4-(3-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C33H44O17 (712.2578374)

6-[(1r,5s,6r)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-(4-hydroxy-4-methylpentyl)cyclohex-2-en-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

C40H40O12 (712.251964)

5-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-6-{4-[4-(4-hydroxy-3,5-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-2-(hydroxymethyl)oxane-3,4-diol

C33H44O17 (712.2578374)

[(2r,3r)-2-(4-hydroxy-3-methoxyphenyl)-5-(3-{[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C40H40O12 (712.251964)

[(1r,3as,3bs,5s,5as,7s,8s,9as,11ar)-1-[(2r)-4-(1-isopropyl-2-methylcyclopropyl)butan-2-yl]-3a,9a,11a-trimethyl-7,8-bis(sulfooxy)-1h,2h,3h,3bh,4h,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-5-yl]oxidanesulfonic acid

[(1r,3as,3bs,5s,5as,7s,8s,9as,11ar)-1-[(2r)-4-(1-isopropyl-2-methylcyclopropyl)butan-2-yl]-3a,9a,11a-trimethyl-7,8-bis(sulfooxy)-1h,2h,3h,3bh,4h,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-5-yl]oxidanesulfonic acid

C31H52O12S3 (712.2620751999999)

4-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[(3-methoxy-4-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}phenyl)methyl]oxolan-2-one

C33H44O17 (712.2578374)

(2r,3s,4s,5r,6s)-6-{4-[(1r,3as,4s,6as)-4-(4-hydroxy-3,5-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-5-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)oxane-3,4-diol

(2r,3s,4s,5r,6s)-6-{4-[(1r,3as,4s,6as)-4-(4-hydroxy-3,5-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-5-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)oxane-3,4-diol

C33H44O17 (712.2578374)

[2-(4-hydroxy-3-methoxyphenyl)-5-(3-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C40H40O12 (712.251964)

(2r,3s,4s,5r,6s)-6-{4-[(1r,3as,4r,6as)-4-(4-hydroxy-3,5-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-5-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)oxane-3,4-diol

(2r,3s,4s,5r,6s)-6-{4-[(1r,3as,4r,6as)-4-(4-hydroxy-3,5-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-5-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)oxane-3,4-diol

C33H44O17 (712.2578374)

1,4-bis[(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl] (2s)-2-hydroxy-2-isopropylbutanedioate

C33H44O17 (712.2578374)

[(1r,3as,5s,7s,8s,9as,11ar)-1-[4-(1-isopropyl-2-methylcyclopropyl)butan-2-yl]-3a,9a,11a-trimethyl-7,8-bis(sulfooxy)-1h,2h,3h,3bh,4h,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-5-yl]oxidanesulfonic acid

[(1r,3as,5s,7s,8s,9as,11ar)-1-[4-(1-isopropyl-2-methylcyclopropyl)butan-2-yl]-3a,9a,11a-trimethyl-7,8-bis(sulfooxy)-1h,2h,3h,3bh,4h,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-5-yl]oxidanesulfonic acid

C31H52O12S3 (712.2620751999999)

1,4-bis[(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl] 2-hydroxy-2-isopropylbutanedioate

C33H44O17 (712.2578374)