Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 15:17:48 UTC
Update Date2022-08-31 06:50:40 UTC
Metabolite IDMMDBc0025548
Metabolite Identification
Common NameTrichobrasilenol
DescriptionTrichobrasilenol belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. Based on a literature review very few articles have been published on Trichobrasilenol.
Structure
Synonyms
ValueSource
2-[(1S,3AS,4E,7as)-1,6,6-trimethyl-hexahydro-1H-inden-4-ylidene]propan-1-olChEBI
2-[(1S,3AS,4E,7as)-1,6,6-trimethyl-octahydro-1H-inden-4-ylidene]propan-1-olChEBI
Molecular FormulaC15H26O
Average Mass222.372
Monoisotopic Mass222.198365457
IUPAC Name2-[(1S,3aS,4E,7aS)-1,6,6-trimethyl-octahydro-1H-inden-4-ylidene]propan-1-ol
Traditional Name2-[(1S,3aS,4E,7aS)-1,6,6-trimethyl-hexahydro-1H-inden-4-ylidene]propan-1-ol
CAS Registry NumberNot Available
SMILES
[H][C@]1(C)CC[C@]2([H])\C(CC(C)(C)C[C@@]12[H])=C(/C)CO
InChI Identifier
InChI=1S/C15H26O/c1-10-5-6-12-13(10)7-15(3,4)8-14(12)11(2)9-16/h10,12-13,16H,5-9H2,1-4H3/b14-11+/t10-,12-,13-/m0/s1
InChI KeyDJBXKQSFHIRXRM-JRYBIPSHSA-N