CHEBI:77722 - apigenin 7-O-β-D-glucoside(1−)

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ChEBI Name apigenin 7-O-β-D-glucoside(1−)
ChEBI ID CHEBI:77722
ChEBI ASCII Name apigenin 7-O-beta-D-glucoside(1-)
Definition A flavonoid oxoanion that is the conjugate base of apigenin 7-O-β-D-glucoside, obtained by deprotonation of the 7-hydroxy group. 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 C21H19O10
Net Charge -1
Average Mass 431.37010
Monoisotopic Mass 431.09837
InChI InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/p-1/t16-,18-,19+,20-,21-/m1/s1
InChIKey KMOUJOKENFFTPU-QNDFHXLGSA-M
SMILES OC[C@H]1O[C@@H](Oc2cc([O-])c3c(c2)oc(cc3=O)-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Roles Classification
Biological Role(s): antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): non-steroidal anti-inflammatory drug
An anti-inflammatory drug that is not a steroid. In addition to anti-inflammatory actions, non-steroidal anti-inflammatory drugs have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing apigenin 7-O-β-D-glucoside(1−) (CHEBI:77722) has role antibacterial agent (CHEBI:33282)
apigenin 7-O-β-D-glucoside(1−) (CHEBI:77722) has role metabolite (CHEBI:25212)
apigenin 7-O-β-D-glucoside(1−) (CHEBI:77722) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
apigenin 7-O-β-D-glucoside(1−) (CHEBI:77722) is a flavonoid oxoanion (CHEBI:60038)
apigenin 7-O-β-D-glucoside(1−) (CHEBI:77722) is conjugate base of apigenin 7-O-β-D-glucoside (CHEBI:16778)
Incoming apigenin 7-O-β-D-glucoside (CHEBI:16778) is conjugate acid of apigenin 7-O-β-D-glucoside(1−) (CHEBI:77722)
IUPAC Name
7-(β-D-glucopyranosyloxy)-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-olate
Synonym Source
apigenin 7-O-β-D-glucoside UniProt
Last Modified
19 June 2014