CHEBI:69001 - dysolenticin E

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ChEBI Name dysolenticin E
ChEBI ID CHEBI:69001
Definition A tirucallane triterpenoid isolated from Dysoxylum lenticellatum.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C30H48O4
Net Charge 0
Average Mass 472.69970
Monoisotopic Mass 472.35526
InChI InChI=1S/C30H48O4/c1-18(2)25(32)30(33)16-19(17-34-30)20-10-14-29(7)22-8-9-23-26(3,4)24(31)12-13-27(23,5)21(22)11-15-28(20,29)6/h8,18-21,23-24,31,33H,9-17H2,1-7H3/t19?,20-,21-,23-,24+,27+,28-,29+,30?/m0/s1
InChIKey UTRFMZZTJWAJPP-RADKDSRJSA-N
SMILES CC(C)C(=O)C1(O)CC(CO1)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C
Metabolite of Species Details
Dysoxylum lenticellatum (IPNI:578201-1) Found in leaf (BTO:0000713). Compound is an epimeric mixture. 95% Ethanolic extract of air-dried, powdered leaves and twigs. See: PubMed
Dysoxylum lenticellatum (IPNI:578201-1) Found in twig (BTO:0001411). Compound is an epimeric mixture. 95% Ethanolic extract of air-dried, powdered leaves and twigs. 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 dysolenticin E (CHEBI:69001) has role plant metabolite (CHEBI:76924)
dysolenticin E (CHEBI:69001) is a cyclic hemiketal (CHEBI:59780)
dysolenticin E (CHEBI:69001) is a tirucallane triterpenoid (CHEBI:83211)
IUPAC Name
(3α,13α,14β,17α,20ξ)-3,23-dihydroxy-21,23-epoxylanost-7-en-24-one
Registry Number Type Source
22011333 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21954912 PubMed citation Europe PMC
Last Modified
01 October 2014
General Comment
2013-11-13 The compound is isolated as a a mixture of epimers at C-23.