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CHEBI:69002 - dysolenticin F

Default Structure
ChEBI IDCHEBI:69002
ChEBI Namedysolenticin F
Stars
DefinitionA tetracyclic triterpenoid found in Dysoxylum lenticellatum.
Last Modified9 January 2014
DownloadsMolfile
FormulaC32H52O4
Net Charge0
Average Mass500.764
Monoisotopic Mass500.38656
SMILES[H][C@]12CC[C@@]3(C)[C@]([H])(C4CO[C@@](OCC)([C@]5([H])OC5(C)C)C4)CC[C@]3(C)C1=CC[C@@]1([H])C(C)(C)[C@H](O)CC[C@]21C
InChIInChI=1S/C32H52O4/c1-9-34-32(26-28(4,5)36-26)18-20(19-35-32)21-12-16-31(8)23-10-11-24-27(2,3)25(33)14-15-29(24,6)22(23)13-17-30(21,31)7/h10,20-22,24-26,33H,9,11-19H2,1-8H3/t20?,21-,22-,24-,25+,26+,29+,30-,31+,32+/m0/s1
InChIKeyODYWIKPNSKWRFZ-SZDISNEQSA-N
Species of MetaboliteComponentSourceComments
Dysoxylum lenticellatum (IPNI:578201-1)
twig (BTO:0001411) PubMed (21954912) 95% Ethanolic extract of air-dried, powdered leaves and twigs.
leaf (BTO:0000713) PubMed (21954912) 95% Ethanolic extract of air-dried, powdered leaves and twigs.
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
dysolenticin F (CHEBI:69002) has role plant metabolite (CHEBI:76924)
dysolenticin F (CHEBI:69002) is a epoxide (CHEBI:32955)
dysolenticin F (CHEBI:69002) is a tetracyclic triterpenoid (CHEBI:26893)
IUPAC Name 
(3α,13α,14β,17α,20ξ,23R,24S)-23-ethoxy-21,23:24,25-diepoxylanost-7-en-3-ol
Registry NumbersSources
Reaxys:22011338Reaxys
Citations