CHEBI:77989 - luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)](3−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)](3−)
ChEBI ID CHEBI:77989
ChEBI ASCII Name luteolin 7-O-[(beta-D-glucosiduronate)-(1->2)-(beta-D-glucosiduronate)](3-)
Definition A flavonoid oxoanion that is a trianionic form of luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)]. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C27H23O18
Net Charge -3
Average Mass 635.46240
Monoisotopic Mass 635.09008
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
InChIKey PBBVWJQPAZYQDB-DBFWEQBMSA-K
SMILES O[C@@H]1[C@@H](O)[C@H](O[C@@H]2[C@@H](O)[C@H](O)[C@H](O[C@H]2Oc2cc([O-])c3c(c2)oc(cc3=O)-c2ccc(O)c(O)c2)C([O-])=O)O[C@@H]([C@H]1O)C([O-])=O
ChEBI Ontology
Outgoing luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)](3−) (CHEBI:77989) is a carbohydrate acid derivative anion (CHEBI:63551)
luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)](3−) (CHEBI:77989) is a flavonoid oxoanion (CHEBI:60038)
luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)](3−) (CHEBI:77989) is conjugate base of luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)] (CHEBI:57815)
Incoming luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)] (CHEBI:57815) is conjugate acid of luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)](3−) (CHEBI:77989)
IUPAC Name
2-(3,4-dihydroxyphenyl)-7-{[2-O-(β-D-glucopyranuronosyl)-β-D-glucopyranuronosyl]oxy}-4-oxo-4H-chromen-5-olate
Synonym Source
luteolin 7-O-[(β-D-glucuronosyl)-(1→2)-(β-D-glucuronide)] UniProt
Last Modified
10 September 2018