CHEBI:67481 - ethyl lansiolate

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ChEBI Name ethyl lansiolate
ChEBI ID CHEBI:67481
Definition A triterpenoid that is the ethyl ester of lansiolic acid. It has been isolated from the twigs of Lansium domesticum.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C32H52O3
Net Charge 0
Average Mass 484.75350
Monoisotopic Mass 484.39165
InChI InChI=1S/C32H52O3/c1-10-35-29(34)18-20-31(8)24(21(2)3)13-11-22(4)25(31)14-15-26-23(5)12-16-27-30(6,7)28(33)17-19-32(26,27)9/h11,24-28,33H,2,5,10,12-20H2,1,3-4,6-9H3/t24-,25-,26-,27-,28-,31-,32+/m0/s1
InChIKey MBFTWDFKACXAAV-XXYMEPQGSA-N
SMILES CCOC(=O)CC[C@@]1(C)[C@@H](CC=C(C)[C@@H]1CC[C@H]1C(=C)CC[C@H]2C(C)(C)[C@@H](O)CC[C@]12C)C(C)=C
Metabolite of Species Details
Lansium domesticum (NCBI:txid201017) Found in twig (BTO:0001411). 95% ethanolic extract of air-dried and powdered twigs See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
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 ethyl lansiolate (CHEBI:67481) has functional parent lansiolic acid (CHEBI:67483)
ethyl lansiolate (CHEBI:67481) has role antibacterial agent (CHEBI:33282)
ethyl lansiolate (CHEBI:67481) has role metabolite (CHEBI:25212)
ethyl lansiolate (CHEBI:67481) has role plant metabolite (CHEBI:76924)
ethyl lansiolate (CHEBI:67481) is a ethyl ester (CHEBI:23990)
ethyl lansiolate (CHEBI:67481) is a secondary alcohol (CHEBI:35681)
ethyl lansiolate (CHEBI:67481) is a triterpenoid (CHEBI:36615)
IUPAC Name
ethyl 3-[(1S,2S,6S)-2-{2-[(1S,4aR,6S,8aR)-6-hydroxy-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]ethyl}-1,3-dimethyl-6-(prop-1-en-2-yl)cyclohex-3-en-1-yl]propanoate
Registry Number Type Source
21534275 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21401117 PubMed citation Europe PMC
Last Modified
02 March 2015