CHEBI:67477 - lamesticumin D

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ChEBI Name lamesticumin D
ChEBI ID CHEBI:67477
Definition A triterpenoid of the class of onoceranoid-type terpenoids 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 C30H46O3
Net Charge 0
Average Mass 454.68440
Monoisotopic Mass 454.34470
InChI InChI=1S/C30H46O3/c1-18-9-12-23-27(3,4)25(32)13-15-29(23,7)20(18)10-11-21-19(2)22(31)17-24-28(5,6)26(33)14-16-30(21,24)8/h20,22-24,31H,1,9-17H2,2-8H3/t20-,22+,23-,24-,29+,30+/m0/s1
InChIKey MGVFDWIGIYHFIO-CKQYGLACSA-N
SMILES CC1=C(CC[C@H]2C(=C)CC[C@H]3C(C)(C)C(=O)CC[C@]23C)[C@@]2(C)CCC(=O)C(C)(C)[C@@H]2C[C@H]1O
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 lamesticumin D (CHEBI:67477) has role antibacterial agent (CHEBI:33282)
lamesticumin D (CHEBI:67477) has role metabolite (CHEBI:25212)
lamesticumin D (CHEBI:67477) has role plant metabolite (CHEBI:76924)
lamesticumin D (CHEBI:67477) is a cyclic terpene ketone (CHEBI:36130)
lamesticumin D (CHEBI:67477) is a octahydronaphthalenes (CHEBI:138397)
lamesticumin D (CHEBI:67477) is a secondary alcohol (CHEBI:35681)
lamesticumin D (CHEBI:67477) is a triterpenoid (CHEBI:36615)
IUPAC Name
(4aS,7R,8aR)-7-hydroxy-1,1,4a,6-tetramethyl-5-{2-[(1S,4aR,8aR)-5,5,8a-trimethyl-2-methylidene-6-oxodecahydronaphthalen-1-yl]ethyl}-3,4,4a,7,8,8a-hexahydronaphthalen-2(1H)-one
Registry Number Type Source
21534279 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21401117 PubMed citation Europe PMC
Last Modified
07 September 2017