CHEBI:58911 - delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-β-D-glucoside(1−)

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ChEBI Name delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-β-D-glucoside(1−)
ChEBI ID CHEBI:58911
ChEBI ASCII Name delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-beta-D-glucoside(1-)
Definition Anion of delphinidin 3-O-(6''-O-malonyl)-β-D-glucoside arising from deprotonation of the malonyl carboxy and 5-hydroxy groups.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H21O15
Net Charge -1
Average Mass 549.41450
Monoisotopic Mass 549.08859
InChI InChI=1S/C24H22O15/c25-9-3-11(26)10-5-15(23(37-14(10)4-9)8-1-12(27)19(32)13(28)2-8)38-24-22(35)21(34)20(33)16(39-24)7-36-18(31)6-17(29)30/h1-5,16,20-22,24,33-35H,6-7H2,(H5-,25,26,27,28,29,30,32)/p-1/t16-,20-,21+,22-,24-/m1/s1
InChIKey FNFHDAUGLIPVPU-XQKZCQIMSA-M
SMILES O[C@@H]1[C@@H](COC(=O)CC([O-])=O)O[C@@H](Oc2cc3c([O-])cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@H]1O
ChEBI Ontology
Outgoing delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-β-D-glucoside(1−) (CHEBI:58911) is a monocarboxylic acid anion (CHEBI:35757)
delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-β-D-glucoside(1−) (CHEBI:58911) is conjugate acid of delphinidin 3-O-(6''-O-malonyl)-β-D-glucoside(2−) (CHEBI:77887)
delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-β-D-glucoside(1−) (CHEBI:58911) is conjugate base of delphinidin 3-O-(6''-O-malonyl)-β-D-glucoside (CHEBI:55334)
Incoming delphinidin 3-O-(6''-O-malonyl)-β-D-glucoside (CHEBI:55334) is conjugate acid of delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-β-D-glucoside(1−) (CHEBI:58911)
delphinidin 3-O-(6''-O-malonyl)-β-D-glucoside(2−) (CHEBI:77887) is conjugate base of delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-β-D-glucoside(1−) (CHEBI:58911)
IUPAC Name
7-hydroxy-5-oxido-2-(3,4,5-trihydroxyphenyl)chromenium-3-yl 6-O-(carboxylatoacetyl)-β-D-glucopyranoside
Synonym Source
delphinidin 3-O-(6''-O-malonyl)-β-D-glucoside anion ChEBI
Last Modified
11 June 2014