| 2D Structure | |
| CID | 7335 |
| Target | CYP2D6 |
| IUPAC Name | (2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl) acetate |
| InChI | InChI=1S/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3 |
| InChI Key | YTHRBOFHFYZBRJ-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CCC(CC1OC(=O)C)C(=C)C |
| Isomeric SMILES | CC1=CCC(CC1OC(=O)C)C(=C)C |
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.27 |
| synonyms | ['CARVYL ACETATE', '97-42-7', 'p-Mentha-6,8-dien-2-ol, acetate', '2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, acetate', 'p-Mentha-1(6),8-dien-2-yl acetate', '1-p-Mentha-6(8,9)-dien-2-yl acetate', '2-METHYL-5-(PROP-1-EN-2-YL)CYCLOHEX-2-EN-1-YL ACETATE', 'EINECS 202-580-2', 'BRN 2330666', 'DTXSID3024738', '2-Methyl-5-(1-methylethenyl)-2-cyclohexen-1-yl acetate', 'DTXCID904738', '2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, 1-acetate', '1-06-00-00061 (Beilstein Handbook Reference)', '2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,5R)-rel-', 'CARVEYL ACETATE', '2-METHYL-5-(1-METHYLETHENYL)-2-CYCLOHEXEN-1-OL, ACETATE', 'Carveol acetate', '(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl) acetate', '1205-42-1', '5-isopropenyl-2-methylcyclohex-2-en-1-yl acetate', 'trans-Carveyl acetate', 'CAS-97-42-7', '(1R,5R)-carvyl acetate', '(1S,5R)-carvyl acetate', 'Carvyl acetate E;', '5-Isopropenyl-2-methyl-2-cyclohexen-1-yl acetate #', 'SCHEMBL347350', '6-Acetoxy-p-menta-1,8-diene', '6-Acetoxy-p-mentha-1,8-diene', 'CHEMBL1351619', 'FEMA 2250', 'CHEBI:230156', 'Tox21_201728', 'Tox21_303105', 'MFCD00001559', 'AKOS015912485', 'NCGC00091401-01', 'NCGC00091401-02', 'NCGC00256971-01', 'NCGC00259277-01', 'NS00012782', '(-)-Carvyl acetate, mixture of cis and trans', 'G75079', '5-Isopropenyl-2-methyl-2-cyclohexen-1-yl acetate', 'SR-01000481252', 'Q4686651', 'SR-01000481252-1'] |
From Pubchem