ethyl lansiolate (CHEBI:67481)

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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

Download	Molfile XML SDF

Formula

C32H52O3

Net Charge

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	Type	Source
21401117	PubMed citation	Europe PMC

Last Modified

02 March 2015

CHEBI:67481 - ethyl lansiolate

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