CHEBI:70269 - cabraleahydroxylactone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cabraleahydroxylactone
ChEBI ID CHEBI:70269
Definition A tetracyclic triterpenoid isolated from the stems of Aglaia abbreviata.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C27H44O3
Net Charge 0
Average Mass 416.63650
Monoisotopic Mass 416.32905
InChI InChI=1S/C27H44O3/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/h17-21,28H,7-16H2,1-6H3/t17-,18+,19+,20-,21-,24+,25-,26-,27+/m1/s1
InChIKey AHDUWGQSZYSNEY-HUOCPXEISA-N
SMILES C[C@]1(CCC(=O)O1)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@@H](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 cabraleahydroxylactone (CHEBI:70269) has role plant metabolite (CHEBI:76924)
cabraleahydroxylactone (CHEBI:70269) is a γ-lactone (CHEBI:37581)
cabraleahydroxylactone (CHEBI:70269) is a secondary alcohol (CHEBI:35681)
cabraleahydroxylactone (CHEBI:70269) is a tetracyclic triterpenoid (CHEBI:26893)
IUPAC Name
(3α,5α)-3-hydroxy-4,4,8,14-tetramethyl-20,24-epoxy-18-norcholan-24-one
Registry Number Type Source
1628323 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21087017 PubMed citation Europe PMC
Last Modified
01 June 2015