CHEBI:7500 - neocarlinoside

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ChEBI Name neocarlinoside
ChEBI ID CHEBI:7500
Definition A flavone C-glycoside that is flavone substituted by hydroxy groups at positions 5, 7, 3' and 4' and a β-D-glucopyranosyl and a β-L-arabinopyranosyl residue via C-glycosidic linkages at positions 6 and 8 respectively
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H28O15
Net Charge 0
Average Mass 580.49150
Monoisotopic Mass 580.14282
InChI InChI=1S/C26H28O15/c27-5-13-18(33)21(36)23(38)26(41-13)15-19(34)14-10(30)4-12(7-1-2-8(28)9(29)3-7)40-24(14)16(20(15)35)25-22(37)17(32)11(31)6-39-25/h1-4,11,13,17-18,21-23,25-29,31-38H,5-6H2/t11-,13+,17-,18+,21-,22+,23+,25+,26-/m0/s1
InChIKey XBGYTZHKGMCEGE-LQYCTPBQSA-N
SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)c([C@H]2OC[C@H](O)[C@H](O)[C@H]2O)c2oc(cc(=O)c2c1O)-c1ccc(O)c(O)c1
Metabolite of Species Details
Oryza sativa (NCBI:txid4530) 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 neocarlinoside (CHEBI:7500) has functional parent flavone (CHEBI:42491)
neocarlinoside (CHEBI:7500) has role plant metabolite (CHEBI:76924)
neocarlinoside (CHEBI:7500) is a flavone C-glycoside (CHEBI:83280)
neocarlinoside (CHEBI:7500) is a tetrahydroxyflavone (CHEBI:38684)
Manual Xrefs Databases
C00006188 KNApSAcK
C10109 KEGG COMPOUND
HMDB0037408 HMDB
LMPK12110490 LIPID MAPS
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Registry Numbers Types Sources
6563442 Reaxys Registry Number Reaxys
83151-89-7 CAS Registry Number KEGG COMPOUND
Citation Waiting for Citations Type Source
24310066 PubMed citation Europe PMC
Last Modified
09 June 2015