CAS 3691-12-1 appears in our catalog under these names: α–Guaiene, Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-, (1S,4S,7R)-, 95%, alfa-Guaiene, a-Guaiene (>85%), Alpha-Guaiene (>85%). Offered by: GLPBio, Chemat Brand, TRC, Biosynth, MedChemExpress. Available pack sizes: 1mg, on request, 100mg, 10mg, 50mg, 5mg, 500μg, 25mg.
Alpha-guaiene is a carbobicyclic compound and sesquiterpene that is 1,2,3,4,5,6,7,8-octahydroazulene which is substituted by methyl groups at positions 1 and 4 and by a (prop-1-en-2-yl group at position 7 (the 1S,4S,7R enantiomer). It has a role as a volatile oil component and a plant metabolite. It is a sesquiterpene and a carbobicyclic compound.
Source: ChEBI
| Molecular formula | C15H24 |
|---|---|
| Molecular weight | 204.35 g/mol |
| IUPAC name | (1S,4S,7R)-1,4-dimethyl-7-prop-1-en-2-yl-1,2,3,4,5,6,7,8-octahydroazulene |
| InChIKey | ADIDQIZBYUABQK-RWMBFGLXSA-N |
| SMILES | C[C@H]1CC[C@H](CC2=C1CC[C@@H]2C)C(=C)C |
Computed by PubChem (NCBI)