| 2D Structure | |
| CID | 94275 |
| Target | / |
| IUPAC Name | (3S,3aS,5R)-3,8-dimethyl-5-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroazulene |
| InChI | InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h12-13,15H,1,5-9H2,2-4H3/t12-,13+,15-/m0/s1 |
| InChI Key | YHAJBLWYOIUHHM-GUTXKFCHSA-N |
| Canonical SMILES | CC1CCC2=C(CCC(CC12)C(=C)C)C |
| Isomeric SMILES | C[C@H]1CCC2=C(CC[C@H](C[C@@H]12)C(=C)C)C |
| Molecular Formula | C15H24 |
| Molecular Weight | 204.35 |
| synonyms | ['delta-Guaiene', 'alpha-Bulnesene', '(+)-alpha-bulnesene', '.delta.-Guaiene', '.alpha.-Bulnesene', '2U8L6FYE8U', '(3S,3aS,5R)-3,8-dimethyl-5-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroazulene', '.DELTA.-BULNESENE', '(3S,3aS,5R)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene', 'CHEBI:63447', 'DTXSID30190387', 'a-Bulnesene', '(3R,3AS,5S)-3,8-DIMETHYL-5-PROP-1-EN-2-YL-1,2,3,3A,4,5,6,7-OCTAHYDROAZULENE', 'Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-dimethyl-7-(1-methylethenyl)-, (1S,7R,8aS)-', 'Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-dimethyl-7-(1-methylethenyl)-, (1S-(1alpha,4alpha,7alpha))-', '(+)-a-Bulnesene', 'DELTA-BULNESENE', 'DTXCID40112878', '5-Isopropenyl-3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulene-, [1S-(1.alpha.,7.alpha.,8a.beta.)]-', '5-Isopropenyl-3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulene-, (1S-(1alpha,7alpha,8abeta))-', '885-851-3', 'Azulene, 1,2,3,5,6,7,8,8a-octahydro-1,4-dimethyl-7-(1-methylethenyl)-, (1S-(1alpha,7alpha,8abeta))-', 'yhajblwyoiuhhm-nejhnugdsa-n', '3691-11-0', 'Guaia-1(10),11-diene', 'Alpha-Bulnesene (>90%)', 'UNII-2U8L6FYE8U', 'HY-N12995', 'CS-1100256', 'NS00114008', 'C20174', 'Q27132629', '(1S,7R,8aS)-1,2,3,5,6,7,8,8a-Octahydro-1,4-dimethyl-7-(1-methylethenyl)azulene; 1,2,3,5,6,7,8,8a-Octahydro-1,4-dimethyl-7-(1-methylethenyl)-[1S-(1alpha,7alpha,8abeta)]-azulene; alpha-Bulnesene'] |
From Pubchem