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CHEBI:234604 - alpha-patchoulene

ChEBI IDCHEBI:234604
ChEBI Namealpha-patchoulene
Stars
DefinitionA sesquiterpene side product of patchoulol synthase from Pogostemon cablin.
SubmitterMartin Engst
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILES[H][C@@]12C[C@H]3CC=C(C)[C@]1(CC[C@@H]2C)C3(C)C
InChIInChI=1S/C15H24/c1-10-7-8-15-11(2)5-6-12(9-13(10)15)14(15,3)4/h5,10,12-13H,6-9H2,1-4H3/t10-,12+,13-,15-/m0/s1
InChIKeyKVQOADNSNSUAJT-QJZXMWHDSA-N
Species of MetaboliteComponentSourceComments
Pogostemon cablin- DOI (10.3762/bjoc.18.2)
ChEBI Ontology
Outgoing Relation(s)
alpha-patchoulene (CHEBI:234604) is a sesquiterpene (CHEBI:35189)