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CHEBI:67479 - lamesticumin F

ChEBI IDCHEBI:67479
ChEBI Namelamesticumin F
Stars
DefinitionA triterpenoid of the class of onoceranoid-type terpenoids isolated from the twigs of Lansium domesticum.
Last Modified23 September 2018
DownloadsMolfile
FormulaC30H50O3
Net Charge0
Average Mass458.727
Monoisotopic Mass458.37600
SMILES[H][C@@]12CC=C(C)[C@H](CC/C=C(\C)CC/C=C(\C)CC[C@@H](O)C(C)(C)O)[C@@]1(C)CCC(=O)C2(C)C
InChIInChI=1S/C30H50O3/c1-21(11-9-12-22(2)15-18-27(32)29(6,7)33)13-10-14-24-23(3)16-17-25-28(4,5)26(31)19-20-30(24,25)8/h12-13,16,24-25,27,32-33H,9-11,14-15,17-20H2,1-8H3/b21-13+,22-12+/t24-,25-,27+,30+/m0/s1
InChIKeyRYDUWPYFQUMUJP-JAKYJIPASA-N
Species of MetaboliteComponentSourceComments
Lansium domesticum (ncbitaxon:201017) twig (BTO:0001411) PubMed (21401117) 95% ethanolic extract of air-dried and powdered twigs
Roles Classification
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
lamesticumin F (CHEBI:67479) has role antibacterial agent (CHEBI:33282)
lamesticumin F (CHEBI:67479) has role metabolite (CHEBI:25212)
lamesticumin F (CHEBI:67479) has role plant metabolite (CHEBI:76924)
lamesticumin F (CHEBI:67479) is a cyclic terpene ketone (CHEBI:36130)
lamesticumin F (CHEBI:67479) is a diol (CHEBI:23824)
lamesticumin F (CHEBI:67479) is a hexahydronaphthalenes (CHEBI:142348)
lamesticumin F (CHEBI:67479) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(4aR,5S,8aR)-5-[(3E,7E,11R)-11,12-dihydroxy-4,8,12-trimethyltrideca-3,7-dien-1-yl]-1,1,4a,6-tetramethyl-3,4,4a,5,8,8a-hexahydronaphthalen-2(1H)-one
Registry NumbersSources
Reaxys:21534276Reaxys
Citations