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CHEBI:221723 - Brasilane C

ChEBI IDCHEBI:221723
ChEBI NameBrasilane C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O2
Net Charge0
Average Mass238.371
Monoisotopic Mass238.19328
SMILESC=C(C)[C@]1(O)CC(C)(C)C[C@H]2[C@H](CO)CC[C@H]21
InChIInChI=1S/C15H26O2/c1-10(2)15(17)9-14(3,4)7-12-11(8-16)5-6-13(12)15/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13+,15+/m0/s1
InChIKeyNCDABFRVOGLXAB-RMRHIDDWSA-N
Species of MetaboliteComponentSourceComments
Coltricia (ncbitaxon:40425) - PubMed (25987321)
ChEBI Ontology
Outgoing Relation(s)
Brasilane C (CHEBI:221723) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,3aR,4S,7aS)-1-(hydroxymethyl)-6,6-dimethyl-4-prop-1-en-2-yl-2,3,3a,5,7,7a-hexahydro-1H-inden-4-ol
Manual XrefsDatabases
78442324ChemSpider