CHEBI:69004 - 24,25-epoxytirucall-7-ene-3,23-dione

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ChEBI Name 24,25-epoxytirucall-7-ene-3,23-dione
ChEBI ID CHEBI:69004
Definition A tirucallane triterpenoid found in Dysoxylum lenticellatum.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C30H46O3
Net Charge 0
Average Mass 454.68440
Monoisotopic Mass 454.34470
InChI InChI=1S/C30H46O3/c1-18(17-22(31)25-27(4,5)33-25)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,23,25H,10-17H2,1-8H3/t18?,19-,20-,23-,25-,28+,29-,30+/m0/s1
InChIKey LLEVBDQGRCWBIO-OBDUWLSNSA-N
SMILES CC(CC(=O)[C@@H]1OC1(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]12C
Metabolite of Species Details
Dysoxylum lenticellatum (IPNI:578201-1) Found in twig (BTO:0001411). 95% Ethanolic extract of air-dried, powdered leaves and twigs. See: PubMed
Dysoxylum lenticellatum (IPNI:578201-1) Found in leaf (BTO:0000713). 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 24,25-epoxytirucall-7-ene-3,23-dione (CHEBI:69004) has role plant metabolite (CHEBI:76924)
24,25-epoxytirucall-7-ene-3,23-dione (CHEBI:69004) is a cyclic terpene ketone (CHEBI:36130)
24,25-epoxytirucall-7-ene-3,23-dione (CHEBI:69004) is a epoxide (CHEBI:32955)
24,25-epoxytirucall-7-ene-3,23-dione (CHEBI:69004) is a tirucallane triterpenoid (CHEBI:83211)
IUPAC Name
(13α,14β,17α,20ξ,24R)-24,25-epoxylanost-7-ene-3,23-dione
Registry Number Type Source
22011331 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21954912 PubMed citation Europe PMC
Last Modified
01 October 2014