CHEBI:58678 - luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate
ChEBI ID CHEBI:58678
ChEBI ASCII Name luteolin 7-O-[(beta-D-glucosyluronate)-(1->2)-(beta-D-glucosiduronate)] 4'-O-beta-D-glucosiduronate
Definition A tricarboxylic acid trianion that is the tricarboxylate anion of luteolin 7-O-[(β-D-glucosyluronic acid)-(1→2)-(β-D-glucosiduronic acid)] 4'-O-β-D-glucosiduronic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C33H31O24
Net Charge -3
Average Mass 811.58480
Monoisotopic Mass 811.12217
InChI InChI=1S/C33H34O24/c34-9-3-7(1-2-12(9)53-31-22(43)16(37)18(39)24(54-31)28(45)46)13-6-11(36)15-10(35)4-8(5-14(15)52-13)51-33-27(21(42)20(41)26(56-33)30(49)50)57-32-23(44)17(38)19(40)25(55-32)29(47)48/h1-6,16-27,31-35,37-44H,(H,45,46)(H,47,48)(H,49,50)/p-3/t16-,17-,18-,19-,20-,21-,22+,23+,24-,25-,26-,27+,31+,32-,33+/m0/s1
InChIKey AEYXZGCDWDUIKX-OFFAAIFBSA-K
SMILES O[C@H]1[C@H](O[C@H]2[C@@H](O[C@@H]([C@@H](O)[C@@H]2O)C([O-])=O)Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C([O-])=O)c(O)c2)O[C@@H]([C@@H](O)[C@@H]1O)C([O-])=O
ChEBI Ontology
Outgoing luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate (CHEBI:58678) is a carbohydrate acid derivative anion (CHEBI:63551)
luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate (CHEBI:58678) is a tricarboxylic acid trianion (CHEBI:27092)
luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate (CHEBI:58678) is conjugate acid of luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate(4−) (CHEBI:77825)
luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate (CHEBI:58678) is conjugate base of luteolin 7-O-[(β-D-glucosyluronic acid)-(1→2)-(β-D-glucosiduronic acid)] 4'-O-β-D-glucosiduronic acid (CHEBI:37645)
Incoming luteolin 7-O-[(β-D-glucosyluronic acid)-(1→2)-(β-D-glucosiduronic acid)] 4'-O-β-D-glucosiduronic acid (CHEBI:37645) is conjugate acid of luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate (CHEBI:58678)
luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate(4−) (CHEBI:77825) is conjugate base of luteolin 7-O-[(β-D-glucosyluronate)-(1→2)-(β-D-glucosiduronate)] 4'-O-β-D-glucosiduronate (CHEBI:58678)
Manual Xref Database
LUTEOLIN-7-O-BETA-D-GLUCURONOSYL-1-2 MetaCyc
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Last Modified
17 April 2014