CHEBI:176196 - 2'',6''-Di-O-acetylononin

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ChEBI Name 2'',6''-Di-O-acetylononin
ChEBI ID CHEBI:176196
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H26O11
Net Charge 0
Average Mass 514.483
Monoisotopic Mass 514.14751
InChI InChI=1S/C26H26O11/c1-13(27)33-12-21-23(30)24(31)25(35-14(2)28)26(37-21)36-17-8-9-18-20(10-17)34-11-19(22(18)29)15-4-6-16(32-3)7-5-15/h4-11,21,23-26,30-31H,12H2,1-3H3
InChIKey WAYQNCRYBDCMOP-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(OC(=O)C)C1OC2=CC=3OC=C(C(=O)C3C=C2)C4=CC=C(OC)C=C4)COC(=O)C
Roles Classification
Chemical Role(s): antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
(via acrovestone )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via acrovestone )
EC 1.14.18.1 (tyrosinase) inhibitor
Any EC 1.14.18.* (oxidoreductase acting on paired donors, miscellaneous compound as one donor, incorporating 1 atom of oxygen) inhibitor that interferes with the action of tyrosinase (monophenol monooxygenase), EC 1.14.18.1, an enzyme that catalyses the oxidation of phenols (such as tyrosine) and is widespread in plants and animals.
(via acrovestone )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2'',6''-Di-O-acetylononin (CHEBI:176196) is a acrovestone (CHEBI:2440)
2'',6''-Di-O-acetylononin (CHEBI:176196) is a isoflavonoid (CHEBI:50753)
IUPAC Name
[5-acetyloxy-3,4-dihydroxy-6-[3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate
Manual Xrefs Databases
19855761 ChemSpider
HMDB0039925 HMDB
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