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CHEBI:220856 - Leptoterpene A

ChEBI IDCHEBI:220856
ChEBI NameLeptoterpene A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESCC(C)C1=C2C[C@@](O)(CO)CC[C@H]2[C@@H](C)CC1=O
InChIInChI=1S/C15H24O3/c1-9(2)14-12-7-15(18,8-16)5-4-11(12)10(3)6-13(14)17/h9-11,16,18H,4-8H2,1-3H3/t10-,11-,15+/m0/s1
InChIKeyMKWABJLSWFRLFU-ZIBATOQPSA-N
Species of MetaboliteComponentSourceComments
Leptosphaerulina (ncbitaxon:55172) - PubMed (29172691)
ChEBI Ontology
Outgoing Relation(s)
Leptoterpene A (CHEBI:220856) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4S,4aS,7R)-7-hydroxy-7-(hydroxymethyl)-4-methyl-1-propan-2-yl-3,4,4a,5,6,8-hexahydronaphthalen-2-one
Manual XrefsDatabases
71044343ChemSpider