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CHEBI:157729 - Hedycaryol

ChEBI IDCHEBI:157729
ChEBI NameHedycaryol
Stars
Last Modified31 May 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O
Net Charge0
Average Mass222.372
Monoisotopic Mass222.19837
SMILES[H][C@@]1(C(C)(C)O)C/C=C(/C)CC/C=C(/C)CC1
InChIInChI=1S/C15H26O/c1-12-6-5-7-13(2)9-11-14(10-8-12)15(3,4)16/h6,9,14,16H,5,7-8,10-11H2,1-4H3/b12-6-,13-9-/t14-/m0/s1
InChIKeySDMLCXJKAYFHQM-LIJSYYTGSA-N
Species of MetaboliteComponentSourceComments
Piper methysticum (ncbitaxon:130404)
stem (BTO:0001300) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
crown root (PO:0000043) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
lateral root (BTO:0005441) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
ChEBI Ontology
Outgoing Relation(s)
Hedycaryol (CHEBI:157729) is a germacrane sesquiterpenoid (CHEBI:68588)
IUPAC Name 
2-[(1S,3Z,7Z)-4,8-dimethylcyclodeca-3,7-dien-1-yl]propan-2-ol
Manual XrefsDatabases
4937499ChemSpider