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CHEBI:172936 - longiborneol

ChEBI IDCHEBI:172936
ChEBI Namelongiborneol
Stars
DefinitionA sesquiterpenoid that is (1R,3aR,4S,8aS)-1,5,5,8a-tetramethyldecahydro-1,4-methanoazulene substituted by a hydroxy group at position 9S.
Last Modified7 January 2025
SubmitterTereza Calounova
DownloadsMolfile
FormulaC15H26O
Net Charge0
Average Mass222.372
Monoisotopic Mass222.19837
SMILES[H][C@@]12CC[C@@]3(C)[C@@H](O)[C@]1([H])C(C)(C)CCC[C@@]23C
InChIInChI=1S/C15H26O/c1-13(2)7-5-8-14(3)10-6-9-15(14,4)12(16)11(10)13/h10-12,16H,5-9H2,1-4H3/t10-,11-,12+,14+,15+/m1/s1
InChIKeyMNNFKQAYXGEKFA-MUGBGTHKSA-N
Species of MetaboliteComponentSourceComments
Pinus densiflora (ncbitaxon:77912) - PubMed (24263436)
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
insect attractant  A chemical that attracts insects.
ChEBI Ontology
Outgoing Relation(s)
longiborneol (CHEBI:172936) has role insect attractant (CHEBI:24850)
longiborneol (CHEBI:172936) has role plant metabolite (CHEBI:76924)
longiborneol (CHEBI:172936) is a carbotricyclic compound (CHEBI:38032)
longiborneol (CHEBI:172936) is a secondary alcohol (CHEBI:35681)
longiborneol (CHEBI:172936) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,3aR,4S,8aS,9S)-1,5,5,8a-tetramethyldecahydro-1,4-methanoazulen-9-ol
Synonyms  Source
juniperolChEBI
(+)-juniperolChEBI
(+)-longiborneolChEBI
(1R,3aR,4S,8aS,9S)-decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulen-9-olChEBI
(1R,3aR,4S,8aS,9S)-(+)-decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulen-9-olChEBI
UniProt Name  Source
longiborneolUniProt
Manual XrefsDatabases
CPD-8761MetaCyc
C00050146KNApSAcK
Registry NumbersSources
CAS:465-24-7NIST Chemistry WebBook
Citations