Feedback

luteolin 7-O-[(beta-D-glucuronosyl)-(1->2)-(beta-D-glucuronide)]

Properties

Image

Occurences in reactions

MNX_ID

MNXM2129

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₂₇H₂₃O₁₈

charge

-3

mass

635.09008

reference

chebi:77989

InChIKey

PBBVWJQPAZYQDB-DBFWEQBMSA-K

InChI

InChI=1S/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)/p-3/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m0/s1

SMILES

O=C([O-])[C@H]1O[C@@H](Oc2cc([O-])c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c2)[C@H](O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:77989 chebi:77989	luteolin 7-O-[(beta-D-glucuronosyl)-(1->2)-(beta-D-glucuronide)] 2-(3,4-dihydroxyphenyl)-7-{[2-O-(beta-D-glucopyranuronosyl)-beta-D-glucopyranuronosyl]oxy}-4-oxo-4H-chromen-5-olate luteolin 7-O-[(beta-D-glucosiduronate)-(1->2)-(beta-D-glucosiduronate)](3-)
hmdb:HMDB0060297	Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] (2S,3S,4S,5R,6R)-6-{[(2S,3R,4S,5S,6S)-6-carboxy-2-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl]oxy}-4,5-dihydroxyoxan-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid (2S,3S,4S,5R,6R)-6-{[(2S,3R,4S,5S,6S)-6-carboxy-2-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy}-4,5-dihydroxyoxan-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid Luteolin 7-O-[b-D-glucuronosyl-(1->2)-b-D-glucuronide] Luteolin 7-O-b-D-diglucuronide Luteolin 7-O-beta-D-diglucuronide Luteolin-7-O-[b-D-glucuronosyl-(1->2)-b-D-glucuronide] Luteolin-7-O-[b-glucuronosyl-(1->2)-b-glucuronide] Luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] Luteolin-7-O-[beta-glucuronosyl-(1->2)-beta-glucuronide]
kegg.compound:C12632 keggC:C12632	Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] Luteolin 7-O-beta-D-diglucuronide
seed.compound:cpd09263 seedM:cpd09263	Luteolin 7-O-beta-D-diglucuronide Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] luteolin 7-O-[beta-D-glucosyluronate-(1->2)-beta-D-glucuronide] luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] luteolin 7-O-beta-D-diglucuronide
CHEBI:57815 chebi:57815	luteolin 7-O-[(beta-D-glucosiduronate)-(1->2)-(beta-D-glucosiduronate)] 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronate luteolin 7-O-[(beta-glucosiduronate)-(1->2)-(beta-glucosiduronate)] luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide](2-)
metacyc.compound:LUTEOLIN-7-O-BETA-D-DIGLUCURONIDE metacycM:LUTEOLIN-7-O-BETA-D-DIGLUCURONIDE	luteolin 7-O-beta-D-diglucuronide luteolin 7-O-[beta-D-glucosyluronate-(1->2)-beta-D-glucuronide]
CHEBI:60077 chebi:60077	luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronic acid Luteolin 7-O-beta-D-diglucuronide luteolin-7-O-[beta-glucuronosyl-(1->2)-beta-glucuronide]
hmdb:HMDB60297 keggC:M_C12632 seedM:M_cpd09263	secondary/obsolete/fantasy identifier