CHEBI:131779 - isoorientin 2''-O-glucoside

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ChEBI Name isoorientin 2''-O-glucoside
ChEBI ID CHEBI:131779
ChEBI ASCII Name isoorientin 2''-O-glucoside
Definition A tetrahydroxyflavone that consists of isoorientin having a β-glucosyl residue attached at position 2''.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H30O16
Net Charge 0
Average Mass 610.519
Monoisotopic Mass 610.15338
InChI InChI=1S/C27H30O16/c28-6-15-20(35)23(38)26(43-27-24(39)22(37)19(34)16(7-29)42-27)25(41-15)18-12(33)5-14-17(21(18)36)11(32)4-13(40-14)8-1-2-9(30)10(31)3-8/h1-5,15-16,19-20,22-31,33-39H,6-7H2/t15-,16-,19-,20-,22+,23+,24-,25+,26-,27+/m1/s1
InChIKey QWAZWXOCSOFIPS-FASGCTRLSA-N
SMILES C1=2C(OC(=CC1=O)C3=CC(=C(C=C3)O)O)=CC(=C(C2O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@@H](CO)O5)O)O)O)O
Metabolite of Species Details
Dianthus chinensis (NCBI:txid118431) Found in aerial part (BTO:0001658). See: PubMed
Passiflora incarnata (NCBI:txid159425) See: PubMed
Oryza sativa (NCBI:txid4530) Found in seed See: PubMed
Oryza sativa (NCBI:txid4530) Found in seed See: MetaboLights Study
Oryza sativa (NCBI:txid4530) Found in leaf (BTO:0000713). See: PubMed
Roles Classification
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing isoorientin 2''-O-glucoside (CHEBI:131779) has functional parent isoorientin (CHEBI:17965)
isoorientin 2''-O-glucoside (CHEBI:131779) has role plant metabolite (CHEBI:76924)
isoorientin 2''-O-glucoside (CHEBI:131779) is a flavone C-glycoside (CHEBI:83280)
isoorientin 2''-O-glucoside (CHEBI:131779) is a polyphenol (CHEBI:26195)
isoorientin 2''-O-glucoside (CHEBI:131779) is a tetrahydroxyflavone (CHEBI:38684)
IUPAC Name
(1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-6-yl]-2-O-β-D-glucopyranosyl-D-glucitol
Synonyms Sources
isoorientin 2''-glucopyranoside ChEBI
isoorientin 2''-glucoside ChEBI
Isoorientin 2''-O-glucopyranoside LIPID MAPS
Meloside L KNApSAcK
Manual Xrefs Databases
C00006210 KNApSAcK
HMDB0029478 HMDB
LMPK12110497 LIPID MAPS
View more database links
Registry Numbers Types Sources
55196-48-0 CAS Registry Number KNApSAcK
8101267 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
2026709 PubMed citation Europe PMC
23849114 PubMed citation Europe PMC
26860358 PubMed citation Europe PMC
7764590 PubMed citation Europe PMC
IND500678013 Agricola citation Europe PMC
Last Modified
18 November 2016