CHEBI:70268 - cabralealactone

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ChEBI Name cabralealactone
ChEBI ID CHEBI:70268
Definition A tetracyclic triterpenoid isolated from the stems of Aglaia abbreviata.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H42O3
Net Charge 0
Average Mass 414.62060
Monoisotopic Mass 414.31340
InChI InChI=1S/C27H42O3/c1-23(2)19-10-15-26(5)20(24(19,3)13-11-21(23)28)8-7-17-18(9-14-25(17,26)4)27(6)16-12-22(29)30-27/h17-20H,7-16H2,1-6H3/t17-,18+,19+,20-,24+,25-,26-,27+/m1/s1
InChIKey NOLGXQBEFHYZHI-QPBHWVAKSA-N
SMILES C[C@]1(CCC(=O)O1)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
Metabolite of Species Details
Aglaia abbreviata (IPNI:576946-1) Found in stem (BTO:0001300). 95% ethanolic extract of air-dried stems 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 cabralealactone (CHEBI:70268) has role plant metabolite (CHEBI:76924)
cabralealactone (CHEBI:70268) is a γ-lactone (CHEBI:37581)
cabralealactone (CHEBI:70268) is a cyclic terpene ketone (CHEBI:36130)
cabralealactone (CHEBI:70268) is a tetracyclic triterpenoid (CHEBI:26893)
IUPAC Name
(5α)-4,4,8,14-tetramethyl-20,24-epoxy-18-norcholane-3,24-dione
Synonym Source
(20S)-23,24-epoxy-25,26,27-trinordammarane-3,24-dione ChEBI
Registry Number Type Source
95091 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21087017 PubMed citation Europe PMC
Last Modified
01 June 2015