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CHEBI:70455 - 2'''-episilvestrol

ChEBI IDCHEBI:70455
ChEBI Name2'''-episilvestrol
Stars
DefinitionA natural product found in Aglaia foveolata.
Last Modified22 September 2014
DownloadsMolfile
FormulaC34H38O13
Net Charge0
Average Mass654.665
Monoisotopic Mass654.23124
SMILES[H][C@]1([C@H](O)CO)CO[C@H](OC)[C@H](Oc2cc(OC)c3c(c2)O[C@@]2(c4ccc(OC)cc4)[C@H](c4ccccc4)[C@@H](C(=O)OC)[C@@H](O)[C@@]32O)O1
InChIInChI=1S/C34H38O13/c1-40-20-12-10-19(11-13-20)34-27(18-8-6-5-7-9-18)26(30(38)42-3)29(37)33(34,39)28-23(41-2)14-21(15-24(28)47-34)45-32-31(43-4)44-17-25(46-32)22(36)16-35/h5-15,22,25-27,29,31-32,35-37,39H,16-17H2,1-4H3/t22-,25-,26-,27-,29-,31+,32-,33+,34+/m1/s1
InChIKeyGVKXFVCXBFGBCD-GTDORJALSA-N
Species of MetaboliteComponentSourceComments
Aglaia foveolata (IPNI:968391-1) stem (BTO:0001300) PubMed (20939540) Previous component: stem bark; Methanolic extract of dried stem bark
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
2'''-episilvestrol (CHEBI:70455) has role metabolite (CHEBI:25212)
2'''-episilvestrol (CHEBI:70455) is a flavagline (CHEBI:71504)
Citations