CHEBI:36524 - guaiane

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ChEBI Name guaiane
ChEBI ID CHEBI:36524
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C15H28
Net Charge 0
Average Mass 208.38282
Monoisotopic Mass 208.21910
InChI InChI=1S/C15H28/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h10-15H,5-9H2,1-4H3/t11-,12-,13+,14-,15-/m0/s1
InChIKey QAQCPAHQVOKALN-RMEBNNNOSA-N
SMILES [H][C@@]12CC[C@H](C)[C@]1([H])C[C@@H](CC[C@@H]2C)C(C)C
ChEBI Ontology
Outgoing guaiane (CHEBI:36524) is a sesquiterpene (CHEBI:35189)
guaiane (CHEBI:36524) is a terpenoid fundamental parent (CHEBI:35662)
Incoming guaiane sesquiterpenoid (CHEBI:36744) has parent hydride guaiane (CHEBI:36524)
guaiazulene (CHEBI:5550) has parent hydride guaiane (CHEBI:36524)
IUPAC Name
guaiane
Synonyms Sources
(1S,3aS,4S,7R,8aS)-1,4-dimethyl-7-(propan-2-yl)decahydroazulene IUPAC
(1S,3aS,4S,7R,8aS)-7-isopropyl-1,4-dimethyldecahydroazulene IUPAC
Registry Number Type Source
2038180 Beilstein Registry Number Beilstein
Last Modified
10 October 2006