Exact Mass: 498.13953960000003

N,N'-Bis(gamma-glutamyl)cystine

C16H26N4O10S2 (498.10902960000004)

N,N-Bis(gamma-glutamyl)cystine is found in mushrooms. N,N-Bis(gamma-glutamyl)cystine is isolated from chives (Allium schoenoprasum) and from shiitake mushrooms (Lentinus edodes). Isolated from chives (Allium schoenoprasum) and from shiitake mushrooms (Lentinus edodes). N,N-Bis(gamma-glutamyl)cystine is found in mushrooms and onion-family vegetables.

3,4-Dicaffeoyl-1,5-quinolactone

C25H22O11 (498.11620619999997)

3,4-Dicaffeoyl-1,5-quinolactone is a polyphenol compound found in foods of plant origin (PMID: 20428313)

Musabalbisiane B

C23H30O12 (498.173718)

Musabalbisiane B is found in fruits. Musabalbisiane B is a constituent of Musa balbisiana. Constituent of Musa balbisiana. Musabalbisiane B is found in fruits.

Eucaglobulin

C23H30O12 (498.173718)

Eucaglobulin is a constituent of Eucalyptus globulus (Tasmanian blue gum). Constituent of Eucalyptus globulus (Tasmanian blue gum)

Methyl 4,6-di-O-galloyl-beta-D-glucopyranoside

C21H22O14 (498.1009512)

Gallotannin from Sanguisorba officinalis (burnet bloodwort). Methyl 4,6-di-O-galloyl-beta-D-glucopyranoside is found in tea and herbs and spices. Methyl 4,6-di-O-galloyl-beta-D-glucopyranoside is found in herbs and spices. Gallotannin from Sanguisorba officinalis (burnet bloodwort).

Artonol D

C30H26O7 (498.1678446)

Artonol D is found in breadfruit. Artonol D is a constituent of the bark of Artocarpus communis (breadfruit) Constituent of the bark of Artocarpus communis (breadfruit). Artonol D is found in breadfruit and fruits.

Dukunolide B

C26H26O10 (498.15258960000006)

Dukunolide B is found in fruits. Dukunolide B is from Lansium domesticum (langsat

7-[3-(4-Acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-oxo-8-propylchromene-2-carboxylic acid

C27H30O9 (498.18897300000003)

D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D020024 - Leukotriene Antagonists D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists

Tyr-Val-Ala-Asp-chloromethyl ketone

C22H31ClN4O7 (498.1881166)

Verproside

C22H26O13 (498.13733460000003)

NSC645271

C22H26O13 (498.13733460000003)

MCULE-8807669340

C23H30O12 (498.173718)

Cypellocarpin A

C23H30O12 (498.173718)

Heteroclitin E

C27H30O9 (498.18897300000003)

Parguerol 16-acetate

C24H35BrO6 (498.16168700000003)

6-O-Vanilloylajugol

C23H30O12 (498.173718)

Globulusin B

C23H30O12 (498.173718)

Seguinoside H

C22H26O13 (498.13733460000003)

Interiotherin B

C27H30O9 (498.18897300000003)

A lignan with a dibenzocyclooctadiene skeleton attached to a fatty acid ester side chain. It is isolated from Kadsura interior and has been shown to exhibit anti-HIV activity.

Xylogranatin Q

C27H30O9 (498.18897300000003)

Palodesangren A

C30H26O7 (498.1678446)

Ikarisoside E

C26H26O10 (498.15258960000006)

Trifochalcanoloside III

C23H30O12 (498.173718)

Briaexcavatolide M

C24H31ClO9 (498.16565060000005)

Schisantherin L

C27H30O9 (498.18897300000003)

Diospyrosonaphthoside

C23H30O12 (498.173718)

Sphenalactone C

C27H30O9 (498.18897300000003)

Milolide C

C24H31ClO9 (498.16565060000005)

Palodesangren B

C30H26O7 (498.1678446)

Dehydroatalantin

C27H30O9 (498.18897300000003)

phylloflavan

C26H26O10 (498.15258960000006)

Artonol D

C30H26O7 (498.1678446)

MCULE-9263771358

C22H21F3N2O6S (498.10723620000005)

malvidin-arabinoside

C22H23ClO11 (498.0928838)

Peonidin-3-o-galactoside

C22H23ClO11 (498.0928838)

5,8-dihydroxy-2-methyl[1,4]naphthoquinone-5-O-beta-xylopyranosyl-(1->6)-beta-glucopyranoside|diospyroside B

C22H26O13 (498.13733460000003)

NSC644013

C25H22O11 (498.11620619999997)

brianthein X

C24H31ClO9 (498.16565060000005)

C27H30O9

C27H30O9 (498.18897300000003)

methyl 3,6-di-O-galloyl-beta-D-glucoside|Methyl-(O3,O6-digalloyl-beta-D-glucopyranosid)|methyl-(O3,O6-digalloyl-beta-D-glucopyranoside)

C21H22O14 (498.1009512)

1-O-beta-D-(2,4-dihydroxy-6-methoxyphenyl)-6-O-(4-hydroxy-3,5-dimethoxybenzoyl)-glucopyranoside

C22H26O13 (498.13733460000003)

Nauclecosidine

C25H26N2O9 (498.1638226)

NSC341587

C24H35BrO6 (498.16168700000003)

symcomoside A

C22H26O13 (498.13733460000003)

6-O-(4-methoxybenzoyl)-5,7-bisdeoxycynanchoside

C23H30O12 (498.173718)

calophyllumin A

C25H22O11 (498.11620619999997)

Dehydroaustin

C27H30O9 (498.18897300000003)

12-Hydroxydaphnetoxin

C27H30O9 (498.18897300000003)

Leptolepisol C|leptopepisol C

C27H30O9 (498.18897300000003)

3,4,5-Trimethoxyphenyl-(6-O-galloyl)-O-EC-D-glucopyranoside

C22H26O13 (498.13733460000003)

3-Hydroxyumbilicaric acid

C25H22O11 (498.11620619999997)

7-oxo-8,9-dihydroxy-4-N-demethyl-staurosporine trifluoroacetate

C27H22N4O6 (498.1539272)

3-carboxy-5-hydroxy-6-O-beta-D-glucopyranosyl-7-phenyl-3H-benzo[de]isochromen-1-one

C25H22O11 (498.11620619999997)

6-O-alpha-L-rhamnopyranosyl daphnogirin|6-O-alpha-L-rhamnopyranosyl-7-hydroxy-3-(7-methoxy-2-oxo-2H-1-benzopyran-8-yl)-2H-1-benzopyran-2-one

C25H22O11 (498.11620619999997)

piceatannol 4-O-beta-D-glucopyranoside

C26H26O10 (498.15258960000006)

C26H26O10

C26H26O10 (498.15258960000006)

Isonishindaside|nishindaside

C23H30O12 (498.173718)

junceellonoid D|rel-(1R,2R,3R,4S,6R,7S,8S,9R,10R,14R,17R)-9,13-bis(acetyloxy)-4-chloro-3a,4,6,7,8,8a,9,10,11,12,12a,13-dodecahydro-7,8-dihydroxy-1,8a-dimethyl-5,12-dimethylene-5H-6,13a-epoxybenzo[1,5]cyclodeca[1,2-b]furan-2(1H)-one

C24H31ClO9 (498.16565060000005)

Curtisian P

C30H26O7 (498.1678446)

1-(O-2,4,6-trimethoxyphenyl)-6-(O-galloyl)-beta-D-glucopyranoside|2,4,6-trimethoxyphenol 1-O-beta-D-(6-O-galloyl)-glucopyranoside

C22H26O13 (498.13733460000003)

(-)-haplomyrtoside

C25H22O11 (498.11620619999997)

C24H35BrO6

C24H35BrO6 (498.16168700000003)

1-O-3,4,5-trimethoxyphenyl-(2-O-galloyl)-beta-D-glucopyranoside

C22H26O13 (498.13733460000003)

3-O-(6-O-3,4,5-Trihydroxybenzoyl-beta-D-glucopyranoside)-3,4,5-Trihydroxybenzoic acid

C21H22O14 (498.1009512)

2,3-dimethoxy-4,6,alpha,beta-tetrahydroxy-alpha-chalcanol-4-O-beta-D-glucopyranoside|trifochalcanoloside III

C23H30O12 (498.173718)

hopeanol B

C28H18O9 (498.0950778)

3-(4-methoxyphenyl)-7-({6-O-[(E)-1-oxobut-2-en-1-yl]-beta-D-glucopyranosyl}oxy)-4H-1-benzopyran-4-one|4-methoxyisoflavone 7-O-beta-D-{6-[(E)-but-2-enoyl]}glycoside|ammopiptanoside A

C26H26O10 (498.15258960000006)

pilosanol N

C26H26O10 (498.15258960000006)

4-O-glucopyranosyl-4,5-dihydroxy-2,2-dimethylpyran[5,6;6,7]isoflavone|alpinumisoflavone 4-O-beta-glucopyranoside

C26H26O10 (498.15258960000006)

dodovicin C

C27H30O9 (498.18897300000003)

fragilisinin A

C24H31ClO9 (498.16565060000005)

6-hydroxymetatacarboline D

C24H26N4O8 (498.1750556)

3,5-dicaffeoyl shikimic acid

C25H22O11 (498.11620619999997)

penicacid B

C23H30O12 (498.173718)

C25H32Cl2O6

C25H32Cl2O6 (498.1575832)

C25H22O11

C25H22O11 (498.11620619999997)

daphnoretin 7-O-beta-D-glucopyranoside|daphnorin

C25H22O11 (498.11620619999997)

khayseneganin A

C27H30O9 (498.18897300000003)

(2S)-dihydrotricin 4-O-(threo-beta-4-hydroxyphenylglyceryl) ether|calquiquelignan C

C26H26O10 (498.15258960000006)

vanilloyl-1.O-beta-D-glucoside acetate

C22H26O13 (498.13733460000003)

3-O-(beta-D-glucopyranosyluronic acid)-alpha-D-galactopyranuronic acid beta-L-rhamnopyranose 1,2:2,1-dianhydride

C18H26O16 (498.1220796)

2-O-methylhiascic acid

C25H22O11 (498.11620619999997)

Methyl 6-O-digalloyl-??-D-glucopyranoside I

C21H22O14 (498.1009512)

Methyl 6-O-digalloyl-??-D-glucopyranoside II

C21H22O14 (498.1009512)

minabein-5

C24H31ClO9 (498.16565060000005)

5-O-methylhiascic acid

C25H22O11 (498.11620619999997)

Isoparguerol-16-acetate

C24H35BrO6 (498.16168700000003)

10-O-protocatechuyl-catalpol|verproside

C22H26O13 (498.13733460000003)

Peonidin galactoside

C22H23ClO11 (498.0928838)

Peonidin 3-O-galactoside is an anthocyanidin glycoside. Peonidin-3-O-galactoside chloride is an anthocyanin with antioxidant properties[1].

Silyamandin

C25H22O11 (498.11620619999997)

Malvidin arabinoside

C22H23O11.Cl (498.09288380000004)

4,4-bis(6,8-dihydroxy-3-methyl-1-oxoisochromen-7-yl)-2-methoxybutanoic acid

C25H22O11 (498.11620619999997)

3,5-dihydroxy-4-[3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid

C23H30O12 (498.173718)

C22H26O13_(1aS,1bS,2S,5aR,6S,6aS)-2-(beta-D-Glucopyranosyloxy)-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-6-yl 3,4-dihydroxybenzoate

C22H26O13 (498.13733460000003)

C23H30O12_3,4-Dihydroxy-5-[(6-O-{[4-(2-hydroxy-2-propanyl)-1-cyclohexen-1-yl]carbonyl}-beta-D-glucopyranosyl)oxy]benzoic acid

C23H30O12 (498.173718)

C22H26O13

C22H26O13 (498.13733460000003)

Verproside

C22H26O13 (498.13733460000003)

A natural product found in Veronica lavaudiana.

3,5-dihydroxy-4-[3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid

C23H30O12 (498.173718)

3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid

C23H30O12 (498.173718)

Selaginpulvilin I

C33H22O5 (498.1467162)

Dicaffeoyl quinolactone

C25H22O11 (498.11620619999997)

Annotation level-3

4,4-bis(6,8-dihydroxy-3-methyl-1-oxoisochromen-7-yl)-2-methoxybutanoic acid [IIN-based on: CCMSLIB00000848743]

C25H22O11 (498.11620619999997)

4,4-bis(6,8-dihydroxy-3-methyl-1-oxoisochromen-7-yl)-2-methoxybutanoic acid [IIN-based: Match]

C25H22O11 (498.11620619999997)

3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid_77.3\\%

C23H30O12 (498.173718)

3,5-dihydroxy-4-[3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid_major

C23H30O12 (498.173718)

3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid_major

C23H30O12 (498.173718)

verproside_major

C22H26O13 (498.13733460000003)

3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid_74.0\\%

C23H30O12 (498.173718)

3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[4-(2-hydroxypropan-2-yl)cyclohexene-1-carbonyl]oxymethyl]oxan-2-yl]oxybenzoic acid_60.8\\%

C23H30O12 (498.173718)

Ala Asp Met Tyr

C21H30N4O8S (498.178426)

Ala Asp Tyr Met

C21H30N4O8S (498.178426)

Ala Met Asp Tyr

C21H30N4O8S (498.178426)

Ala Met Tyr Asp

C21H30N4O8S (498.178426)

Ala Tyr Asp Met

C21H30N4O8S (498.178426)

Ala Tyr Met Asp

C21H30N4O8S (498.178426)

Cys Cys His His

C18H26N8O5S2 (498.1467506)

Cys Asp Asp Phe

C20H26N4O9S (498.1420426000001)

Cys Asp Phe Asp

C20H26N4O9S (498.1420426000001)

Cys Asp Met Met

C17H30N4O7S3 (498.127655)

Cys Asp Val Tyr

C21H30N4O8S (498.178426)

Cys Asp Tyr Val

C21H30N4O8S (498.178426)

Cys Glu Phe Thr

C21H30N4O8S (498.178426)

Cys Glu Thr Phe

C21H30N4O8S (498.178426)

Cys Phe Asp Asp

C20H26N4O9S (498.1420426000001)

Cys Phe Glu Thr

C21H30N4O8S (498.178426)

Cys Phe Thr Glu

C21H30N4O8S (498.178426)

Cys His Cys His

C18H26N8O5S2 (498.1467506)

Cys His His Cys

C18H26N8O5S2 (498.1467506)

Cys Met Asp Met

C17H30N4O7S3 (498.127655)

Cys Met Met Asp

C17H30N4O7S3 (498.127655)

Cys Thr Glu Phe

C21H30N4O8S (498.178426)

Cys Thr Phe Glu

C21H30N4O8S (498.178426)

Cys Val Asp Tyr

C21H30N4O8S (498.178426)

Cys Val Tyr Asp

C21H30N4O8S (498.178426)

Cys Tyr Asp Val

C21H30N4O8S (498.178426)

Cys Tyr Val Asp

C21H30N4O8S (498.178426)

Asp Ala Met Tyr

C21H30N4O8S (498.178426)

Asp Ala Tyr Met

C21H30N4O8S (498.178426)

Asp Cys Asp Phe

C20H26N4O9S (498.1420426000001)

Asp Cys Phe Asp

C20H26N4O9S (498.1420426000001)

Asp Cys Met Met

C17H30N4O7S3 (498.127655)

Asp Cys Val Tyr

C21H30N4O8S (498.178426)

Asp Cys Tyr Val

C21H30N4O8S (498.178426)

Asp Asp Cys Phe

C20H26N4O9S (498.1420426000001)

Asp Asp Phe Cys

C20H26N4O9S (498.1420426000001)

Asp Asp Ser Tyr

C20H26N4O11 (498.15980060000004)

Asp Asp Tyr Ser

C20H26N4O11 (498.15980060000004)

Asp Phe Cys Asp

C20H26N4O9S (498.1420426000001)

Asp Phe Asp Cys

C20H26N4O9S (498.1420426000001)

Asp Phe Met Ser

C21H30N4O8S (498.178426)

Asp Phe Ser Met

C21H30N4O8S (498.178426)

Asp His Asn Asn

C18H26N8O9 (498.18226660000005)

Asp Met Ala Tyr

C21H30N4O8S (498.178426)

Asp Met Cys Met

C17H30N4O7S3 (498.127655)

Asp Met Phe Ser

C21H30N4O8S (498.178426)

Asp Met Met Cys

C17H30N4O7S3 (498.127655)

Asp Met Ser Phe

C21H30N4O8S (498.178426)

Asp Met Tyr Ala

C21H30N4O8S (498.178426)

Asp Asn His Asn

C18H26N8O9 (498.18226660000005)

Asp Asn Asn His

C18H26N8O9 (498.18226660000005)

Asp Ser Asp Tyr

C20H26N4O11 (498.15980060000004)

Asp Ser Phe Met

C21H30N4O8S (498.178426)

Asp Ser Met Phe

C21H30N4O8S (498.178426)

Asp Ser Tyr Asp

C20H26N4O11 (498.15980060000004)

Asp Val Cys Tyr

C21H30N4O8S (498.178426)

Asp Val Tyr Cys

C21H30N4O8S (498.178426)

Asp Tyr Ala Met

C21H30N4O8S (498.178426)

Asp Tyr Cys Val

C21H30N4O8S (498.178426)

Asp Tyr Asp Ser

C20H26N4O11 (498.15980060000004)

Asp Tyr Met Ala

C21H30N4O8S (498.178426)

Asp Tyr Ser Asp

C20H26N4O11 (498.15980060000004)

Asp Tyr Val Cys

C21H30N4O8S (498.178426)

Glu Cys Phe Thr

C21H30N4O8S (498.178426)

Glu Cys Thr Phe

C21H30N4O8S (498.178426)

Glu Phe Cys Thr

C21H30N4O8S (498.178426)

Glu Phe Thr Cys

C21H30N4O8S (498.178426)

Glu Gly Met Tyr

C21H30N4O8S (498.178426)

Glu Gly Tyr Met

C21H30N4O8S (498.178426)

Glu Met Gly Tyr

C21H30N4O8S (498.178426)

Glu Met Tyr Gly

C21H30N4O8S (498.178426)

Glu Thr Cys Phe

C21H30N4O8S (498.178426)

Glu Thr Phe Cys

C21H30N4O8S (498.178426)

Glu Tyr Gly Met

C21H30N4O8S (498.178426)

Glu Tyr Met Gly

C21H30N4O8S (498.178426)

Phe Cys Asp Asp

C20H26N4O9S (498.1420426000001)

Phe Cys Glu Thr

C21H30N4O8S (498.178426)

Phe Cys Thr Glu

C21H30N4O8S (498.178426)

Phe Asp Cys Asp

C20H26N4O9S (498.1420426000001)

Phe Asp Asp Cys

C20H26N4O9S (498.1420426000001)

Phe Asp Met Ser

C21H30N4O8S (498.178426)

Phe Asp Ser Met

C21H30N4O8S (498.178426)

Phe Glu Cys Thr

C21H30N4O8S (498.178426)

Phe Glu Thr Cys

C21H30N4O8S (498.178426)

Phe Met Asp Ser

C21H30N4O8S (498.178426)

Phe Met Ser Asp

C21H30N4O8S (498.178426)

Phe Ser Asp Met

C21H30N4O8S (498.178426)

Phe Ser Met Asp

C21H30N4O8S (498.178426)

Phe Thr Cys Glu

C21H30N4O8S (498.178426)

Phe Thr Glu Cys

C21H30N4O8S (498.178426)

Gly Glu Met Tyr

C21H30N4O8S (498.178426)

Gly Glu Tyr Met

C21H30N4O8S (498.178426)

Gly Met Glu Tyr

C21H30N4O8S (498.178426)

Gly Met Tyr Glu

C21H30N4O8S (498.178426)

Gly Tyr Glu Met

C21H30N4O8S (498.178426)

Gly Tyr Met Glu

C21H30N4O8S (498.178426)

His Cys Cys His

C18H26N8O5S2 (498.1467506)

His Cys His Cys

C18H26N8O5S2 (498.1467506)

His Asp Asn Asn

C18H26N8O9 (498.18226660000005)

His His Cys Cys

C18H26N8O5S2 (498.1467506)

His Asn Asp Asn

C18H26N8O9 (498.18226660000005)

His Asn Asn Asp

C18H26N8O9 (498.18226660000005)

Met Ala Asp Tyr

C21H30N4O8S (498.178426)

Met Ala Tyr Asp

C21H30N4O8S (498.178426)

Met Cys Asp Met

C17H30N4O7S3 (498.127655)

Met Cys Met Asp

C17H30N4O7S3 (498.127655)

Met Asp Ala Tyr

C21H30N4O8S (498.178426)

Met Asp Cys Met

C17H30N4O7S3 (498.127655)

Met Asp Phe Ser

C21H30N4O8S (498.178426)

Met Asp Met Cys

C17H30N4O7S3 (498.127655)

Met Asp Ser Phe

C21H30N4O8S (498.178426)

Met Asp Tyr Ala

C21H30N4O8S (498.178426)

Met Glu Gly Tyr

C21H30N4O8S (498.178426)

Met Glu Tyr Gly

C21H30N4O8S (498.178426)

Met Phe Asp Ser

C21H30N4O8S (498.178426)

Met Phe Ser Asp

C21H30N4O8S (498.178426)

Met Gly Glu Tyr

C21H30N4O8S (498.178426)

Met Gly Tyr Glu

C21H30N4O8S (498.178426)

Met Met Cys Asp

C17H30N4O7S3 (498.127655)

Met Met Asp Cys

C17H30N4O7S3 (498.127655)

Met Met Met Ser

C18H34N4O6S3 (498.16403840000004)

Met Met Ser Met

C18H34N4O6S3 (498.16403840000004)

Met Ser Asp Phe

C21H30N4O8S (498.178426)

Met Ser Phe Asp

C21H30N4O8S (498.178426)

Met Ser Met Met

C18H34N4O6S3 (498.16403840000004)

Met Tyr Ala Asp

C21H30N4O8S (498.178426)

Met Tyr Asp Ala

C21H30N4O8S (498.178426)

Met Tyr Glu Gly

C21H30N4O8S (498.178426)

Met Tyr Gly Glu

C21H30N4O8S (498.178426)

Asn Asp His Asn

C18H26N8O9 (498.18226660000005)

Asn Asp Asn His

C18H26N8O9 (498.18226660000005)

Asn His Asp Asn

C18H26N8O9 (498.18226660000005)

Asn His Asn Asp

C18H26N8O9 (498.18226660000005)

Asn Asn Asp His

C18H26N8O9 (498.18226660000005)

Asn Asn His Asp

C18H26N8O9 (498.18226660000005)

Ser Asp Asp Tyr

C20H26N4O11 (498.15980060000004)

Ser Asp Phe Met

C21H30N4O8S (498.178426)

Ser Asp Met Phe

C21H30N4O8S (498.178426)

Ser Asp Tyr Asp

C20H26N4O11 (498.15980060000004)

Ser Phe Asp Met

C21H30N4O8S (498.178426)

Ser Phe Met Asp

C21H30N4O8S (498.178426)

Ser Met Asp Phe

C21H30N4O8S (498.178426)

Ser Met Phe Asp

C21H30N4O8S (498.178426)

Ser Met Met Met

C18H34N4O6S3 (498.16403840000004)

Ser Tyr Asp Asp

C20H26N4O11 (498.15980060000004)

Thr Cys Glu Phe

C21H30N4O8S (498.178426)

Thr Cys Phe Glu

C21H30N4O8S (498.178426)

Thr Glu Cys Phe

C21H30N4O8S (498.178426)

Thr Glu Phe Cys

C21H30N4O8S (498.178426)

Thr Phe Cys Glu

C21H30N4O8S (498.178426)

Thr Phe Glu Cys

C21H30N4O8S (498.178426)

Val Cys Asp Tyr

C21H30N4O8S (498.178426)

Val Cys Tyr Asp

C21H30N4O8S (498.178426)

Val Asp Cys Tyr

C21H30N4O8S (498.178426)

Val Asp Tyr Cys

C21H30N4O8S (498.178426)

Val Tyr Cys Asp

C21H30N4O8S (498.178426)

Val Tyr Asp Cys

C21H30N4O8S (498.178426)

Tyr Ala Asp Met

C21H30N4O8S (498.178426)

Tyr Ala Met Asp

C21H30N4O8S (498.178426)

Tyr Cys Asp Val

C21H30N4O8S (498.178426)

Tyr Cys Val Asp

C21H30N4O8S (498.178426)

Tyr Asp Ala Met

C21H30N4O8S (498.178426)

Tyr Asp Cys Val

C21H30N4O8S (498.178426)

Tyr Asp Asp Ser

C20H26N4O11 (498.15980060000004)

Tyr Asp Met Ala

C21H30N4O8S (498.178426)

Tyr Asp Ser Asp

C20H26N4O11 (498.15980060000004)

Tyr Asp Val Cys

C21H30N4O8S (498.178426)

Tyr Glu Gly Met

C21H30N4O8S (498.178426)

Tyr Glu Met Gly

C21H30N4O8S (498.178426)

Tyr Gly Glu Met

C21H30N4O8S (498.178426)

Tyr Gly Met Glu

C21H30N4O8S (498.178426)

Tyr Met Ala Asp

C21H30N4O8S (498.178426)

Tyr Met Asp Ala

C21H30N4O8S (498.178426)

Tyr Met Glu Gly

C21H30N4O8S (498.178426)

Tyr Met Gly Glu

C21H30N4O8S (498.178426)

Tyr Ser Asp Asp

C20H26N4O11 (498.15980060000004)

Tyr Val Cys Asp

C21H30N4O8S (498.178426)

Tyr Val Asp Cys

C21H30N4O8S (498.178426)

TyrMe-Phe4Cl-OH

C25H23ClN2O7 (498.1193718)

3,4-Dicaffeoyl-1,5-quinide

C25H22O11 (498.11620619999997)

Dukunolide B

C26H26O10 (498.15258960000006)

Eucaglobulin

C23H30O12 (498.173718)

N-g-Glutamylcystine

C16H26N4O10S2 (498.10902960000004)

Musabalbisiane B

C23H30O12 (498.173718)

Methyl 4,6-di-O-galloyl-b-D-glucopyranoside

C21H22O14 (498.1009512)

3,5-Dihydroxy-4-[(6-O-{[4-(2-hydroxy-2-propanyl)-1-cyclohexen-1-yl]carbonyl}hexopyranosyl)oxy]benzoic acid

C23H30O12 (498.173718)

4,4-Bis(6,8-dihydroxy-3-methyl-1-oxo-1H-isochromen-7-yl)-2-methoxybutanoic acid

C25H22O11 (498.11620619999997)

Binifibrate

C25H23ClN2O7 (498.1193718)

C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98150 - Fibrate Antilipidemic Agent D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D009676 - Noxae > D000963 - Antimetabolites

N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-4-[(2-methoxy-4-nitrophenyl)azo]naphthalene-2-carboxamide

C25H18N6O6 (498.12877679999997)

(-)-diop

C31H32O2P2 (498.18774319999994)

(+)-diop

C31H32O2P2 (498.18774319999994)

Nicotine Bitartrate

C18H30N2O14 (498.169696)

D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D005731 - Ganglionic Stimulants C78272 - Agent Affecting Nervous System > C47796 - Cholinergic Agonist > C73579 - Nicotinic Agonist D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018679 - Cholinergic Agonists D000077444 - Smoking Cessation Agents

Methotrexate sodium

C20H20N8Na2O5 (498.135199)

C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors D012102 - Reproductive Control Agents > D000019 - Abortifacient Agents C471 - Enzyme Inhibitor > C2153 - Dihydrofolate Reductase Inhibitor D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D004791 - Enzyme Inhibitors > D005493 - Folic Acid Antagonists D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents D018501 - Antirheumatic Agents D003879 - Dermatologic Agents

α,ω-Dihexylquaterthiophene,5,5μ-Bis(3-hexyl-2-thienyl)-2,2μ-bithiophene,DH-4T

C28H34S4 (498.1543244)

Acetic acid,triphenylplumbyl ester

C20H18O2Pb (498.10731379999993)

[(2R,5R)-3-acetyloxy-5-[(5-cyano-6-phenylsulfanylpyridine-3-carbonyl)carbamoylamino]oxolan-2-yl]methyl acetate

C23H22N4O7S (498.1209142)

Clobenoside

C25H32Cl2O6 (498.1575832)

C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

promethazine teoclate

C24H27ClN6O2S (498.16046320000004)

C78272 - Agent Affecting Nervous System > C267 - Antiemetic Agent > C740 - Phenothiazine C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic

PYROGLU-GLY-ARG P-NITROANILIDE

C19H27ClN8O6 (498.1741992)

6-methoxy-3-(4-methoxyphenyl)-3-phenylbenzo[h]indeno[2,1-f]chromen-13(3H)-one

C34H26O4 (498.18309960000005)

1,7-Diazaspiro[4.5]dec-9-en-2-one, 8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-8-phenyl-, (5R,8S)-

C25H24F6N2O2 (498.1741875999999)

peonidin

C22H23ClO11 (498.0928838)

[(6S,8S,9R,10S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-10,13,16-trimethyl-3,11-dioxo-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-yl] propanoate

C25H29F3O5S (498.16877000000005)

benzene-1,3-dicarboxylic acid,2,2-dimethylpropane-1,3-diol,ethane-1,2-diol,terephthalic acid

C23H30O12 (498.173718)

[4-(6-Chloro-Naphthalene-2-Sulfonyl)-Piperazin-1-Yl]-(3,4,5,6-Tetrahydro-2h-[1,4]Bipyridinyl-4-Yl)-Methanone

C25H27ClN4O3S (498.14923020000003)

12-Deoxycarminomycin

C26H28NO9+ (498.1763978)

2-(glutathion-S-yl)-3-(4-nitrophenyl)propanoate

C19H22N4O10S-2 (498.1056592)

[(2S,3S,4S,6R)-6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]azanium

C26H28NO9+ (498.1763978)

(2S)-2-[6-[(3-methyl-1-oxo-2H-benzo[f]quinazolin-9-yl)methylamino]-3-oxo-1H-isoindol-2-yl]pentanedioate

C27H22N4O6-2 (498.1539272)

H-DL-Tyr-DL-Val-DL-Ala-DL-Asp-CH2Cl

C22H31ClN4O7 (498.1881166)

7-oxo-8,9-dihydroxy-4-N-demethyl staurosporine

C27H22N4O6 (498.1539272)

A indolocarbazole alkaloid that is 4-N-demethyl staurosporine substituted by hydroxy groups at positions 8 and 9 and an xo group at position 7. Isolated from Cystodytes solitus, it exhibits antineoplastic activity.

[4-[(E)-[(7-benzyl-1,3-dimethyl-2,6-dioxopurin-8-yl)hydrazinylidene]methyl]phenyl] furan-2-carboxylate

C26H22N6O5 (498.1651602)

DNP-Trp

C22H22N6O8 (498.1499052)

Cys-Cys-His-His

C18H26N8O5S2 (498.1467506)

A tetrapeptide composed of two L-cysteine units joined to two L-histidine units by a peptide linkage.

allyl 3-deoxy-4-O-(3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl)-alpha-D-manno-oct-2-ulopyranosidonic acid

C19H30O15 (498.158463)

4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]-2-ethoxyphenyl 4-methylbenzenesulfonate

C24H26N4O6S (498.15729760000005)

alpha-Kdo-(2->8)-alpha-Kdo-OAll

C19H30O15 (498.158463)

A disaccharide derivative consisting of two 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl units joined via an alpha-(2->8)-linkage with an O-allyl group at the anomeric centre.

N-[4-[1-(benzenesulfonyl)-2,3-dihydroindol-5-yl]-5-methyl-2-thiazolyl]-2-(4-morpholinyl)acetamide

C24H26N4O4S2 (498.13953960000003)

6-Chloro-3-[2-[4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-1-piperazinyl]-2-oxoethyl]-7-hydroxy-4-methyl-1-benzopyran-2-one

C25H23ClN2O7 (498.1193718)

5-cyano-6-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide

C28H26N4O3S (498.1725526)

N-(4-chlorophenyl)-2-[3-(2-furanylmethyl)-4-imino-6,6-dimethyl-2-oxo-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-1-yl]acetamide

C24H23ClN4O4S (498.11284680000006)

N-[4-(6-imidazo[2,1-b]thiazolyl)phenyl]-4-methoxy-3-(4-morpholinylsulfonyl)benzamide

C23H22N4O5S2 (498.1031562)

[2-(4-Amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 4-chloro-3-piperidin-1-ylsulfonylbenzoate

C20H23ClN4O7S (498.09759180000003)

(2R)-2-azaniumyl-4-{4-[(1Z)-2-({(3S)-1-[(R)-carboxylato(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-oxido-2-oxoethanimidoyl]phenoxy}butanoate

C23H22N4O9-2 (498.1386722)

isonocardicin A(2-)

C23H22N4O9-2 (498.1386722)

4-Methyl-2-(6,13,15-trioxo-9-phenyl-3,7-dithia-5,14-diazapentacyclo[9.5.1.02,10.04,8.012,16]heptadec-4(8)-en-14-yl)pentanoic acid

C25H26N2O5S2 (498.12830660000003)

Junceellonoid D

C24H31ClO9 (498.16565060000005)

(1S,9R,10R,11R)-5-(4-fluorophenyl)-10-(hydroxymethyl)-12-(3-methylphenyl)sulfonyl-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylic acid

C25H23FN2O6S (498.126079)

(1R,9S,10S,11S)-5-(4-fluorophenyl)-10-(hydroxymethyl)-12-(3-methylphenyl)sulfonyl-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylic acid

C25H23FN2O6S (498.126079)

Ala-Met-Asp-Tyr

C21H30N4O8S (498.178426)

Asp-Met-Met-Cys

C17H30N4O7S3 (498.127655)

(2S,3S,3aR,9bR)-1-[(2,5-difluorophenyl)methyl]-3-(hydroxymethyl)-6-oxo-7-[(E)-prop-1-enyl]-N-(1,3-thiazol-2-yl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

C25H24F2N4O3S (498.1537098)

(2R,3R,3aS,9bS)-1-[(2,5-difluorophenyl)methyl]-3-(hydroxymethyl)-6-oxo-7-[(E)-prop-1-enyl]-N-(1,3-thiazol-2-yl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

C25H24F2N4O3S (498.1537098)

4,4-Bis(6,8-dihydroxy-3-methyl-1-oxoisochromen-7-yl)-2-methoxybutanoic acid

C25H22O11 (498.11620619999997)

7-[3-(4-Acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-oxo-8-propylchromene-2-carboxylic acid

C27H30O9 (498.18897300000003)

D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D020024 - Leukotriene Antagonists D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists

3,4-Dicaffeoyl-1,5-quinolactone

C25H22O11 (498.11620619999997)

N,N-Bis(gamma-glutamyl)cystine

C16H26N4O10S2 (498.10902960000004)

Methyl 4,6-di-O-galloyl-beta-D-glucopyranoside

C21H22O14 (498.1009512)

alpha-Kdo-(2->4)-alpha-Kdo-OAll

C19H30O15 (498.158463)

A disaccharide derivative consisting of two 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl units joined via an alpha-(2->4)-linkage with an O-allyl group at the anomeric centre.

isonocardicin A(2-)

C23H22N4O9 (498.1386722)

An oxime anion that is the major structure of isonocardicin A at pH 7.3.

nocardicin A(2-)

C23H22N4O9 (498.1386722)

A dicarboxylic acid dianion that is the major structure of isonocardicin A at pH 7.3 (according to Marvin v 6.2.0.).

LPI 9:4;O2

C18H27O14P (498.1138372)

ST 22:6;O8;S

C22H26O11S (498.1195766000001)

ST 23:5;O7;S

C23H30O10S (498.15596000000005)

[(3s,4r,5s)-5-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-hydroxyphenoxy)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl]methyl furan-2-carboxylate

C22H26O13 (498.13733460000003)

(5br,9r,9as,10s)-9-(3,4-dihydroxyphenyl)-10-(4-hydroxy-2-methoxyphenyl)-7-methyl-8,9,9a,10-tetrahydro-5bh-1,11-dioxatetraphen-2-one

C30H26O7 (498.1678446)

(2r,3r)-7,9-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-12-methoxy-2,3-dihydro-1,4,5-trioxatetraphen-10-one

C25H22O11 (498.11620619999997)

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(2,4,6-trimethoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C22H26O13 (498.13733460000003)

1,3,3'-trihydroxy-1',2'-dimethoxy-2-methyl-9'h-[4,9'-bixanthen]-9-one

C29H22O8 (498.1314612)

(1r,3s,5s,6r,7s,8r,10r,12s,13r,14r)-7-{[(2r,3r,4s,5s,6s)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-6,13,14-trihydroxy-12-methyl-2,4,9,11-tetraoxatricyclo[8.4.0.0³,⁸]tetradecane-5-carboxylic acid

C18H26O16 (498.1220796)

(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-2-{[8-hydroxy-3-(hydroxymethyl)naphthalen-1-yl]oxy}-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

C23H30O12 (498.173718)

(1s,12r,13r,14s,15r)-15-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl (2z)-2-methylbut-2-enoate

C27H30O9 (498.18897300000003)

methyl (2e)-3-[(1r,2r,7s,8s,12s)-7-(furan-3-yl)-1,8,15,15-tetramethyl-5,17,18-trioxo-3,6,14-trioxapentacyclo[9.7.0.0²,⁴.0²,⁸.0¹²,¹⁶]octadecan-12-yl]prop-2-enoate

C27H30O9 (498.18897300000003)

(2s)-11-hydroxy-4-oxo-8-phenyl-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),5(13),6,8,10-pentaene-2-carboxylic acid

C25H22O11 (498.11620619999997)

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

C23H30O12 (498.173718)

4-[4-(3,4-dihydroxy-2-methoxy-6-methylbenzoyloxy)-2-hydroxy-6-methylbenzoyloxy]-2-hydroxy-6-methylbenzoic acid

C25H22O11 (498.11620619999997)

(3s)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hex-4-enoic acid

C23H30O12 (498.173718)

(4as,12s,12as)-3-acetyl-4,4a,6,7,12,12a-hexahydroxy-9-methoxy-11-(3-methylbut-2-en-1-yl)-1,12-dihydrotetracene-2,5-dione

C26H26O10 (498.15258960000006)

methyl (2e)-3-[(1r,2r,4s,7s,8s,11r,12s,16r)-7-(furan-3-yl)-1,8,15,15-tetramethyl-5,17,18-trioxo-3,6,14-trioxapentacyclo[9.7.0.0²,⁴.0²,⁸.0¹²,¹⁶]octadecan-12-yl]prop-2-enoate

C27H30O9 (498.18897300000003)

(3s)-3-[(2r,3r,4s,5r,6r)-4-(acetyloxy)-3-hydroxy-5-{[(2z)-2-isothiocyanatobut-2-enoyl]oxy}-6-methyloxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohex-1-ene-1-carboxylic acid

C20H22N2O11S (498.09442620000004)

(1r,2r,3s,4s,6r,8s,9r,10s,12s,14s,15r,18r)-10-(acetyloxy)-14-chloro-2-hydroxy-4,9,18-trimethyl-13-methylidene-17-oxo-5,16,19-trioxapentacyclo[10.6.1.0¹,¹⁵.0³,⁹.0⁴,⁶]nonadecan-8-yl acetate

C24H31ClO9 (498.16565060000005)

[(1as,1bs,3r,3ar,5s,7br,9r,9ar)-9-(acetyloxy)-5-[(1r)-1-bromo-2-hydroxyethyl]-3-hydroxy-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-1a-yl]methyl acetate

C24H35BrO6 (498.16168700000003)

[(2r,3s,4r,5r,6r)-4,5-dihydroxy-6-methoxy-3-(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C21H22O14 (498.1009512)

(1s,18s,19s,20s)-19-ethenyl-18-{[(2s,3r,4s,5s,6s)-3,4,5,6-tetrahydroxyoxan-2-yl]oxy}-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-2(11),4,6,8,15-pentaene-10,14-dione

C25H26N2O9 (498.1638226)

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

C25H22O11 (498.11620619999997)

(3r,4as,10ar)-3-chloro-10a-{[(1s,3s,6s)-3-chloro-6-hydroxy-2,2,6-trimethylcyclohexyl]methyl}-6,8-dihydroxy-2,2-dimethyl-3h,4h,4ah-naphtho[2,3-b]pyran-5,10-dione

C25H32Cl2O6 (498.1575832)

(11r,12s,13s)-12-hydroxy-3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.0²,¹⁰.0⁴,⁸.0¹⁷,²¹]docosa-1(15),2,4(8),9,16,21-hexaen-11-yl (2e)-2-methylbut-2-enoate

C27H30O9 (498.18897300000003)

15-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl 2-methylbut-2-enoate

C27H30O9 (498.18897300000003)

6-galloylglucose; beta-d-pyranose-form,me glycoside,o-(3,4-dihydroxybenzoyl)

C21H22O14 (498.1009512)

{"Ingredient_id": "HBIN012351","Ingredient_name": "6-galloylglucose; beta-d-pyranose-form,me glycoside,o-(3,4-dihydroxybenzoyl)","Alias": "NA","Ingredient_formula": "C21H22O14","Ingredient_Smile": "NA","Ingredient_weight": "498.39","OB_score": "NA","CAS_id": "88847-09-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7565","PubChem_id": "NA","DrugBank_id": "NA"}

6-O-vanilloylajugol

C23H30O12 (498.173718)

{"Ingredient_id": "HBIN012725","Ingredient_name": "6-O-vanilloylajugol","Alias": "6-O-Vanilloylajugol; 6-o-vanilloylajugol","Ingredient_formula": "C23H30O12","Ingredient_Smile": "CC1(CC(C2C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=C(C=C4)O)OC)O","Ingredient_weight": "498.5 g/mol","OB_score": "23.43527208","CAS_id": "NA","SymMap_id": "SMIT05763;SMIT18155","TCMID_id": "22323","TCMSP_id": "MOL003733;MOL004615","TCM_ID_id": "NA","PubChem_id": "14396664","DrugBank_id": "NA"}

2-acetyl-3,4a,5,10,11,12a-hexahydroxy-8-methoxy-6-(3-methylbut-2-en-1-yl)-4,5-dihydrotetracene-1,12-dione

C26H26O10 (498.15258960000006)

[3,4,5-trihydroxy-6-(2,4,6-trimethoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C22H26O13 (498.13733460000003)

7-hydroxy-7'-methoxy-6-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-[3,8'-bichromene]-2,2'-dione

C25H22O11 (498.11620619999997)

7-(acetyloxy)-13-chloro-9,10-dihydroxy-8,17-dimethyl-4,12-dimethylidene-16-oxo-15,18-dioxatetracyclo[9.6.1.0¹,¹⁴.0³,⁸]octadecan-2-yl acetate

C24H31ClO9 (498.16565060000005)

5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-3-{[(2s,3s,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}pyrano[2,3-h]chromen-4-one

C26H26O10 (498.15258960000006)

9-(3,4-dihydroxyphenyl)-10-(4-hydroxy-2-methoxyphenyl)-7-methyl-8,9,9a,10-tetrahydro-5bh-1,11-dioxatetraphen-2-one

C30H26O7 (498.1678446)

3-hydroxy-8-methoxy-3-methyl-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2,4-dihydrotetraphene-1,7,12-trione

C26H26O10 (498.15258960000006)

(1r,3s,6r,8s,11s,12s,16r,17s,20s)-16-(furan-3-yl)-3,12-dihydroxy-5,5,11,17-tetramethyl-7,10,15,21-tetraoxaheptacyclo[11.8.1.0¹,²⁰.0³,¹².0⁶,⁸.0⁶,¹¹.0¹⁷,²²]docos-13(22)-ene-4,9,14-trione

C26H26O10 (498.15258960000006)

3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-{[4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carbonyloxy]methyl}oxan-2-yl)oxy]benzoic acid

C23H30O12 (498.173718)

[(1s,2s,4s,5s,6r,10s)-5-hydroxy-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-2-yl]methyl 3,4-dihydroxybenzoate

C22H26O13 (498.13733460000003)

(2r,3s,4r,5r,6s)-2-{[(2r,3s,4r,5r,6s)-4,5-dihydroxy-2-{[8-hydroxy-3-(hydroxymethyl)naphthalen-1-yl]oxy}-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

C23H30O12 (498.173718)

2-[5-hydroxy-2,3-dimethoxy-4-(1,2,3-trihydroxy-3-phenylpropyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C23H30O12 (498.173718)

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

C23H30O12 (498.173718)

(1r,2s,3s,7s,8s,9r,10s,11r,13s,14r,17r)-7-(acetyloxy)-13-chloro-9,10-dihydroxy-8,17-dimethyl-4,12-dimethylidene-16-oxo-15,18-dioxatetracyclo[9.6.1.0¹,¹⁴.0³,⁸]octadecan-2-yl acetate

C24H31ClO9 (498.16565060000005)

4-(2h-1,3-benzodioxol-5-yl)-6-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h-naphtho[2,3-c]furan-1-one

C25H22O11 (498.11620619999997)

4-amino-11,12,18-trihydroxy-5-methoxy-6-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1²,⁶.0⁷,²⁸.0⁸,¹³.0¹⁵,¹⁹.0²⁰,²⁷.0²¹,²⁶]nonacosa-8(13),9,11,14(28),15(19),17,20(27),21(26),22,24-decaen-16-one

C27H22N4O6 (498.1539272)

5-(carboxymethyl)-5-formyl-5'-(furan-3-yl)-2',4,6-trihydroxy-2,8a-bis(hydroxymethyl)-hexahydrospiro[naphthalene-1,3'-oxolane]-4a-carboxylic acid

C23H30O12 (498.173718)

(1s,2s,3r,4r,7s,8e,10e,12s,13s,14r,16s,17r,18r)-2-(acetyloxy)-9-(chloromethyl)-3,12-dihydroxy-4,13,18-trimethyl-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadeca-8,10-dien-17-yl acetate

C24H31ClO9 (498.16565060000005)

(2r,4r,5r,6s)-4-amino-11,12,18-trihydroxy-5-methoxy-6-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1²,⁶.0⁷,²⁸.0⁸,¹³.0¹⁵,¹⁹.0²⁰,²⁷.0²¹,²⁶]nonacosa-8(13),9,11,14(28),15(19),17,20(27),21(26),22,24-decaen-16-one

C27H22N4O6 (498.1539272)

(2s,3r,4s,5s,6r)-2-{5-hydroxy-2,3-dimethoxy-4-[(1s,2s,3s)-1,2,3-trihydroxy-3-phenylpropyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C23H30O12 (498.173718)

methyl 3,4-dihydroxy-5-({3,4,5-trihydroxy-6-[(3,4,5-trihydroxybenzoyloxy)methyl]oxan-2-yl}oxy)benzoate

C21H22O14 (498.1009512)

3-[(2r,3r)-2-(furan-3-yl)-4-[(1s,7r,8s,9s)-9-(methoxycarbonyl)-7,11,11-trimethyl-5,10-dioxatricyclo[6.2.1.0²,⁶]undeca-2(6),3-dien-4-yl]-3-methyl-6-oxo-2h-pyran-3-yl]propanoic acid

C27H30O9 (498.18897300000003)

3-(acetyloxy)-5-(1-bromo-2-hydroxyethyl)-1a-(hydroxymethyl)-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-9-yl acetate

C24H35BrO6 (498.16168700000003)

2-[9-(acetyloxy)-3-hydroxy-1a-(hydroxymethyl)-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-5-yl]-2-bromoethyl acetate

C24H35BrO6 (498.16168700000003)

3,6,27,29-tetrahydroxy-19-oxa-10,12,26,28-tetraazaheptacyclo[23.2.2.2²⁰,²³.1¹⁰,¹⁴.0³,¹¹.0⁴,⁹.0¹³,¹⁸]dotriaconta-4,6,8,13(18),14,16,20,22,26,28,30-undecaen-32-one

C27H22N4O6 (498.1539272)

(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(3,4,5-trimethoxyphenoxy)oxan-3-yl 3,4,5-trihydroxybenzoate

C22H26O13 (498.13733460000003)

9-(2h-1,3-benzodioxol-5-yl)-4-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-7-hydroxy-6-methoxy-3h-naphtho[2,3-c]furan-1-one

C25H22O11 (498.11620619999997)

(8s)-1-{[(2s,3s,4s,5r,6r)-4,5-dihydroxy-3-methoxy-4,6-dimethyloxan-2-yl]oxy}-8,11-dihydroxy-8-methyl-9,10-dihydro-7h-tetracene-5,12-dione

C27H30O9 (498.18897300000003)

(5-{[4,5-dihydroxy-6-(hydroxymethyl)-2-(4-hydroxyphenoxy)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl)methyl furan-2-carboxylate

C22H26O13 (498.13733460000003)

[9-(acetyloxy)-5-(1-bromo-2-hydroxyethyl)-3-hydroxy-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-1a-yl]methyl acetate

C24H35BrO6 (498.16168700000003)

8-hydroxy-2-methyl-5-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]naphthalene-1,4-dione

C22H26O13 (498.13733460000003)

2-[(4,5-dihydroxy-2-{[8-hydroxy-3-(hydroxymethyl)naphthalen-1-yl]oxy}-6-(hydroxymethyl)oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

C23H30O12 (498.173718)

[(3s,4s,5s)-5-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-hydroxyphenoxy)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl]methyl furan-2-carboxylate

C22H26O13 (498.13733460000003)

7-hydroxy-7'-methoxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-[3,8'-bichromene]-2,2'-dione

C25H22O11 (498.11620619999997)

(2s,3r,4s,5s)-2-[2-(3,5-dihydroxybenzoyl)-3,5-dihydroxyphenoxy]-4,5-dihydroxyoxan-3-yl benzoate

C25H22O11 (498.11620619999997)

(2s)-1-[3-(3-{[(1s,2r)-1-carboxy-2-hydroxypropyl]carbamoyl}-6-hydroxy-9h-pyrido[3,4-b]indol-1-yl)propanoyl]pyrrolidine-2-carboxylic acid

C24H26N4O8 (498.1750556)

(1s,2r,3s,4r,7s,8e,10z,12s,13s,14r,16s,17r,18r)-2-(acetyloxy)-9-(chloromethyl)-3,12-dihydroxy-4,13,18-trimethyl-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadeca-8,10-dien-17-yl acetate

C24H31ClO9 (498.16565060000005)

5-hydroxy-8,8-dimethyl-3-(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)pyrano[3,2-g]chromen-4-one

C26H26O10 (498.15258960000006)

5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}pyrano[2,3-h]chromen-4-one

C26H26O10 (498.15258960000006)

2-(4-{4-[2-(3,5-dihydroxyphenyl)ethenyl]phenoxy}-2-hydroxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C26H26O10 (498.15258960000006)

methyl 3-[7-(furan-3-yl)-1,8,15,15-tetramethyl-5,17,18-trioxo-3,6,14-trioxapentacyclo[9.7.0.0²,⁴.0²,⁸.0¹²,¹⁶]octadecan-12-yl]prop-2-enoate

C27H30O9 (498.18897300000003)

(2r,3r,4r,5s,6r)-5-{5-hydroxy-2,3-dimethoxy-4-[(1s,2s,3s)-1,2,3-trihydroxy-3-phenylpropyl]phenoxy}-6-(hydroxymethyl)oxane-2,3,4-triol

C23H30O12 (498.173718)

(5-hydroxy-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-2-yl)methyl 3,4-dihydroxybenzoate

C22H26O13 (498.13733460000003)

3-[2-(furan-3-yl)-4-[9-(methoxycarbonyl)-7,11,11-trimethyl-5,10-dioxatricyclo[6.2.1.0²,⁶]undeca-2(6),3-dien-4-yl]-3-methyl-6-oxo-2h-pyran-3-yl]propanoic acid

C27H30O9 (498.18897300000003)

(12s)-17-hydroxy-7,7,21,21-tetramethyl-12-(prop-1-en-2-yl)-8,20,26-trioxahexacyclo[12.12.0.0²,¹¹.0⁴,⁹.0¹⁶,²⁵.0¹⁹,²⁴]hexacosa-1(14),2(11),4(9),5,16,18,22,24-octaene-3,10,15-trione

C30H26O7 (498.1678446)

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(3,4,5-trimethoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C22H26O13 (498.13733460000003)

(2r)-2-[(1ar,1br,3s,3as,5r,7bs,9s,9as)-9-(acetyloxy)-3-hydroxy-1a-(hydroxymethyl)-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-5-yl]-2-bromoethyl acetate

C24H35BrO6 (498.16168700000003)

(1s,12s,13r,14s,15r)-15-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-12-yl (2e)-2-methylbut-2-enoate

C27H30O9 (498.18897300000003)

{3,4,5-trihydroxy-6-[4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carbonyloxy]oxan-2-yl}methyl 3,4,5-trihydroxybenzoate

C23H30O12 (498.173718)

2-(acetyloxy)-9-(chloromethyl)-3,12-dihydroxy-4,13,18-trimethyl-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadeca-8,10-dien-17-yl acetate

C24H31ClO9 (498.16565060000005)

2-[10-(acetyloxy)-2a,4-dihydroxy-6,8b-dimethyl-1h,2h,2bh,3h,4h,4ah,5h,7h,9h,10h,10ah-cyclobuta[a]phenanthren-6-yl]-2-bromoethyl acetate

C24H35BrO6 (498.16168700000003)

[(2r,3s,4s,5r,6s)-6-(2,4-dihydroxy-6-methoxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3,5-dimethoxybenzoate

C22H26O13 (498.13733460000003)

(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5r,6r)-4,5-dihydroxy-2-{[8-hydroxy-3-(hydroxymethyl)naphthalen-1-yl]oxy}-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

C23H30O12 (498.173718)

(1r,2r,3s,4r,6s,8s,9s,10r,12s,14s,15r,18r)-10-(acetyloxy)-14-chloro-2-hydroxy-4,9,18-trimethyl-13-methylidene-17-oxo-5,16,19-trioxapentacyclo[10.6.1.0¹,¹⁵.0³,⁹.0⁴,⁶]nonadecan-8-yl acetate

C24H31ClO9 (498.16565060000005)

(2s,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl (3r)-5-(3,4-dihydroxyphenyl)-3-hydroxypentanoate

C26H26O10 (498.15258960000006)

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-{[(4r)-4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carbonyloxy]methyl}oxan-2-yl 3,4,5-trihydroxybenzoate

C23H30O12 (498.173718)

(1s,2r,3r,4r,7r,8s,10z,12r,13s,14r,16s,17s,18r)-2-(acetyloxy)-8-chloro-3,12-dihydroxy-4,13,18-trimethyl-9-methylidene-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadec-10-en-17-yl acetate

C24H31ClO9 (498.16565060000005)

8-hydroxy-2-methyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}naphthalene-1,4-dione

C22H26O13 (498.13733460000003)

5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-3-{[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}pyrano[2,3-h]chromen-4-one

C26H26O10 (498.15258960000006)

1-(3-{[(2r,3s)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-8-yl]methyl}-2,4-dihydroxy-6-methoxy-5-methylphenyl)ethanone

C26H26O10 (498.15258960000006)

1-(3-{3-[(1-carboxy-2-hydroxypropyl)carbamoyl]-6-hydroxy-9h-pyrido[3,4-b]indol-1-yl}propanoyl)pyrrolidine-2-carboxylic acid

C24H26N4O8 (498.1750556)

6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hex-4-enoic acid

C23H30O12 (498.173718)

(1s,2s,3r,4r,7s,8z,10e,12s,13s,14r,16s,17r,18r)-2-(acetyloxy)-9-(chloromethyl)-3,12-dihydroxy-4,13,18-trimethyl-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadeca-8,10-dien-17-yl acetate

C24H31ClO9 (498.16565060000005)

(1r,2r,6s,7s,8r,10s,11s,12r,14s,16s,17r,18r)-6,7,17-trihydroxy-8-(hydroxymethyl)-4,18-dimethyl-14-phenyl-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-5-one

C27H30O9 (498.18897300000003)

4,5-dihydroxy-6-(hydroxymethyl)-2-(3,4,5-trimethoxyphenoxy)oxan-3-yl 3,4,5-trihydroxybenzoate

C22H26O13 (498.13733460000003)

(1r,2r,6r,7s,8r,10s,11s,12r,14s,16s,17r,18r)-6,7,17-trihydroxy-8-(hydroxymethyl)-4,18-dimethyl-14-phenyl-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-5-one

C27H30O9 (498.18897300000003)

(2s,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 5-(3,4-dihydroxyphenyl)-3-hydroxypentanoate

C26H26O10 (498.15258960000006)

[(3r,4s,5r)-5-{[(2r,3s,4r,5r,6s)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-hydroxyphenoxy)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl]methyl furan-2-carboxylate

C22H26O13 (498.13733460000003)

2-hydroxy-4-[2-methoxy-6-methyl-4-(3,4,6-trihydroxy-2-methylbenzoyloxy)benzoyloxy]-6-methylbenzoic acid

C25H22O11 (498.11620619999997)

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{[3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-2-yl]methyl (2e)-but-2-enoate

C26H26O10 (498.15258960000006)

(11r,12s,13r,14r)-14-hydroxy-3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.0²,¹⁰.0⁴,⁸.0¹⁷,²¹]docosa-1(15),2,4(8),9,16,21-hexaen-11-yl (2z)-2-methylbut-2-enoate

C27H30O9 (498.18897300000003)

3-acetyl-4,4a,6,7,12,12a-hexahydroxy-9-methoxy-11-(3-methylbut-2-en-1-yl)-1,12-dihydrotetracene-2,5-dione

C26H26O10 (498.15258960000006)

(1as,1bs,3r,3ar,5s,7br,9r,9ar)-3-(acetyloxy)-5-[(1r)-1-bromo-2-hydroxyethyl]-1a-(hydroxymethyl)-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-9-yl acetate

C24H35BrO6 (498.16168700000003)

(2r)-2-[(2ar,2br,4s,4as,6r,8bs,10s,10ar)-10-(acetyloxy)-2a,4-dihydroxy-6,8b-dimethyl-1h,2h,2bh,3h,4h,4ah,5h,7h,9h,10h,10ah-cyclobuta[a]phenanthren-6-yl]-2-bromoethyl acetate

C24H35BrO6 (498.16168700000003)

7-hydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-5-yl 4-hydroxy-3-methoxybenzoate

C23H30O12 (498.173718)

5-[5-hydroxy-2,3-dimethoxy-4-(1,2,3-trihydroxy-3-phenylpropyl)phenoxy]-6-(hydroxymethyl)oxane-2,3,4-triol

C23H30O12 (498.173718)

7-hydroxy-7-(hydroxymethyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-5-yl 4-methoxybenzoate

C23H30O12 (498.173718)

(1r,2r,2'r,4r,4ar,5s,5's,6r,8as)-5-(carboxymethyl)-5-formyl-5'-(furan-3-yl)-2',4,6-trihydroxy-2,8a-bis(hydroxymethyl)-hexahydrospiro[naphthalene-1,3'-oxolane]-4a-carboxylic acid

C23H30O12 (498.173718)

(1r,3s,11s,25r)-3,6,27,29-tetrahydroxy-19-oxa-10,12,26,28-tetraazaheptacyclo[23.2.2.2²⁰,²³.1¹⁰,¹⁴.0³,¹¹.0⁴,⁹.0¹³,¹⁸]dotriaconta-4,6,8,13(18),14,16,20,22,26,28,30-undecaen-32-one

C27H22N4O6 (498.1539272)

2-(acetyloxy)-8-chloro-3,12-dihydroxy-4,13,18-trimethyl-9-methylidene-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadec-10-en-17-yl acetate

C24H31ClO9 (498.16565060000005)

methyl 3,4-dihydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-[(3,4,5-trihydroxybenzoyloxy)methyl]oxan-2-yl]oxy}benzoate

C21H22O14 (498.1009512)

(1s,2r,3r,4r,7r,8s,10z,12r,13s,14r,16s,17r,18r)-2-(acetyloxy)-8-chloro-3,12-dihydroxy-4,13,18-trimethyl-9-methylidene-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadec-10-en-17-yl acetate

C24H31ClO9 (498.16565060000005)

(10z)-2-(acetyloxy)-8-chloro-3,12-dihydroxy-4,13,18-trimethyl-9-methylidene-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadec-10-en-17-yl acetate

C24H31ClO9 (498.16565060000005)

(2r,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl (3r)-5-(3,4-dihydroxyphenyl)-3-hydroxypentanoate

C26H26O10 (498.15258960000006)

14-hydroxy-3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.0²,¹⁰.0⁴,⁸.0¹⁷,²¹]docosa-1(15),2,4(8),9,16,21-hexaen-11-yl 2-methylbut-2-enoate

C27H30O9 (498.18897300000003)

(3s,4ar,10as)-3-chloro-10a-{[(1s,3s,6s)-3-chloro-6-hydroxy-2,2,6-trimethylcyclohexyl]methyl}-6,8-dihydroxy-2,2-dimethyl-3h,4h,4ah-naphtho[2,3-b]pyran-5,10-dione

C25H32Cl2O6 (498.1575832)

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[(4r)-4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carbonyloxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C23H30O12 (498.173718)

(11s,12s,13r,14s)-14-hydroxy-3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.0²,¹⁰.0⁴,⁸.0¹⁷,²¹]docosa-1(15),2,4(8),9,16,21-hexaen-11-yl (2z)-2-methylbut-2-enoate

C27H30O9 (498.18897300000003)

[(2r,3s,4s,5r)-6-{[(1s,4ar,5s,6r,7s,7ar)-5,6-dihydroxy-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate

C23H30O12 (498.173718)

10-(3,4-dihydroxyphenyl)-9-(4-hydroxy-2-methoxyphenyl)-7-methyl-8,9,9a,10-tetrahydro-5bh-1,11-dioxatetraphen-2-one

C30H26O7 (498.1678446)

(2r)-2-[(1as,1bs,3r,3ar,5s,7br,9r,9ar)-9-(acetyloxy)-3-hydroxy-1a-(hydroxymethyl)-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-5-yl]-2-bromoethyl acetate

C24H35BrO6 (498.16168700000003)

(5bs,9r,9as,10s)-10-(3,4-dihydroxyphenyl)-9-(4-hydroxy-2-methoxyphenyl)-7-methyl-8,9,9a,10-tetrahydro-5bh-1,11-dioxatetraphen-2-one

C30H26O7 (498.1678446)

11-hydroxy-4-oxo-8-phenyl-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),5(13),6,8,10-pentaene-2-carboxylic acid

C25H22O11 (498.11620619999997)

(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(2,4,5-trihydroxyphenyl)ethoxy]oxan-3-yl 2-(2,4,5-trihydroxyphenyl)acetate

C22H26O13 (498.13733460000003)

(5br,9r,9as,10s)-10-(3,4-dihydroxyphenyl)-9-(4-hydroxy-2-methoxyphenyl)-7-methyl-8,9,9a,10-tetrahydro-5bh-1,11-dioxatetraphen-2-one

C30H26O7 (498.1678446)

(5-hydroxy-3-methoxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,3h,4h,4ah,5h,7ah-cyclopenta[c]pyran-7-yl)methyl 4-hydroxybenzoate

C23H30O12 (498.173718)

[3,4,5-trihydroxy-6-(3,4,5-trimethoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C22H26O13 (498.13733460000003)

(3r,11s,11as)-2-acetyl-3-benzoyl-11-(7-methoxy-2h-1,3-benzodioxol-5-yl)-1h,3h,4h,11h,11ah-pyrazino[1,2-b]isoquinolin-6-one

C29H26N2O6 (498.1790776)

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

C23H30O12 (498.173718)

(5bs,9r,9as,10s)-9-(3,4-dihydroxyphenyl)-10-(4-hydroxy-2-methoxyphenyl)-7-methyl-8,9,9a,10-tetrahydro-5bh-1,11-dioxatetraphen-2-one

C30H26O7 (498.1678446)

(4as,5s,12as)-2-acetyl-3,4a,5,10,11,12a-hexahydroxy-8-methoxy-6-(3-methylbut-2-en-1-yl)-4,5-dihydrotetracene-1,12-dione

C26H26O10 (498.15258960000006)

(3r)-3-hydroxy-8-methoxy-3-methyl-6-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2,4-dihydrotetraphene-1,7,12-trione

C26H26O10 (498.15258960000006)

4-[4-(4,6-dihydroxy-3-methoxy-2-methylbenzoyloxy)-2-hydroxy-6-methylbenzoyloxy]-2-hydroxy-6-methylbenzoic acid

C25H22O11 (498.11620619999997)

10-(acetyloxy)-14-chloro-2-hydroxy-4,9,18-trimethyl-13-methylidene-17-oxo-5,16,19-trioxapentacyclo[10.6.1.0¹,¹⁵.0³,⁹.0⁴,⁶]nonadecan-8-yl acetate

C24H31ClO9 (498.16565060000005)

(1s,2r,3s,4s,7s,8e,10z,12s,13s,14r,16s,17r,18r)-2-(acetyloxy)-9-(chloromethyl)-3,12-dihydroxy-4,13,18-trimethyl-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadeca-8,10-dien-17-yl acetate

C24H31ClO9 (498.16565060000005)

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

C23H30O12 (498.173718)

5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]pyrano[2,3-h]chromen-4-one

C26H26O10 (498.15258960000006)

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

C23H30O12 (498.173718)

[(2r,3s,4s,5r,6s)-6-{[(1s,4ar,5r,7s,7as)-5,7-dihydroxy-7-methyl-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate

C23H30O12 (498.173718)

(2r)-2-[(1ar,1bs,3r,3ar,5r,7br,9r,9ar)-9-(acetyloxy)-3-hydroxy-1a-(hydroxymethyl)-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-5-yl]-2-bromoethyl acetate

C24H35BrO6 (498.16168700000003)

3,4-dihydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-{[(4r)-4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carbonyloxy]methyl}oxan-2-yl]oxy}benzoic acid

C23H30O12 (498.173718)

(2s,3r,4s,5s,6r)-2-(4-{4-[(1e)-2-(3,5-dihydroxyphenyl)ethenyl]phenoxy}-2-hydroxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C26H26O10 (498.15258960000006)

3-[4-(acetyloxy)-3-hydroxy-5-[(2-isothiocyanatobut-2-enoyl)oxy]-6-methyloxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohex-1-ene-1-carboxylic acid

C20H22N2O11S (498.09442620000004)

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

C23H30O12 (498.173718)

7-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-6,13,14-trihydroxy-12-methyl-2,4,9,11-tetraoxatricyclo[8.4.0.0³,⁸]tetradecane-5-carboxylic acid

C18H26O16 (498.1220796)

[6-(2,4-dihydroxy-6-methoxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3,5-dimethoxybenzoate

C22H26O13 (498.13733460000003)

(3,4,5-trihydroxy-6-{[3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-2-yl)methyl but-2-enoate

C26H26O10 (498.15258960000006)

9-(2h-1,3-benzodioxol-5-yl)-4-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-7-hydroxy-6-methoxy-3h-naphtho[2,3-c]furan-1-one

C25H22O11 (498.11620619999997)

(1s,2r,3r,4r,7r,8s,10e,12s,13s,14r,16s,17r,18r)-2-(acetyloxy)-8-chloro-3,12-dihydroxy-4,13,18-trimethyl-9-methylidene-5-oxo-6,15-dioxatetracyclo[11.5.0.0³,⁷.0¹⁴,¹⁶]octadec-10-en-17-yl acetate

C24H31ClO9 (498.16565060000005)

(1s,2s,4s,5s,6s,10s)-2-(hydroxymethyl)-10-{[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-5-yl 3,4-dihydroxybenzoate

C22H26O13 (498.13733460000003)