| 2D Structure | |
| CID | 6654 |
| Target | CYP2D6 |
| IUPAC Name | 2,6,6-trimethylbicyclo[3.1.1]hept-2-ene |
| InChI | InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3 |
| InChI Key | GRWFGVWFFZKLTI-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CCC2CC1C2(C)C |
| Isomeric SMILES | CC1=CCC2CC1C2(C)C |
| Molecular Formula | C10H16 |
| Molecular Weight | 136.23 |
| synonyms | ['ALPHA-PINENE', '2-Pinene', 'Acintene A', '2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene', 'pin-2(3)-ene', 'Pinene isomer', '2437-95-8', 'alfa-Pinene', 'Sylvapine A', 'PINENE, ALPHA', 'NSC 7727', 'pin-2-ene', 'Leavo-95', 'DTXSID4026501', 'CHEBI:36740', '(+-)-2-pinene', 'NSC-7727', '2,6,6-Trimethylbicyclo(3.1.1)-2-hept-2-ene', 'PC-500(TERPENE)', 'FEMA No. 2902', 'alpha-Pinene (natural)', 'FEMA Number 2902', 'DTXCID006501', '4,6,6-Trimethylbicyklo(3,1,1)hept-3-en', '2,6,6-Trimethylbicyclo(3.1.1)hept-2-ene', 'CCRIS 697', 'PC-500', 'HSDB 720', 'DL-Pin-2(3)-ene', 'EINECS 201-291-9', 'EINECS 219-445-9', 'UNII-JPF3YI7O34', 'BRN 3194807', 'AI3-24594', 'Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl', '2,6,6-Trimethylbicyclo(3.1.1)-2-heptene', '2,6,6-Trimethylbicyclo[3.1.1]-2-heptene', 'EC 201-291-9', '4-05-00-00456 (Beilstein Handbook Reference)', 'AUSTRALENE', '(+-)-alpha-pinene', 'PINENE (ALPHA)', 'alpha-PINENE, (+-)-', 'Pesticide Code: 067004.', 'Trimethyl Bicyclo (3.1.1) hept-2-ene', '2,6,6-TRIMETHYLBICYCLO (3.1.1)HEPT-2-ENE, 9CL', 'BICYCLO(3.1.1)HEPT-2-ENE,2,6,6-TRIMETHYL-2-PINENE', '201-291-9', '80-56-8 2437-95-8', '80-56-8', '.alpha.-Pinene', '(+/-)-2-Pinene', 'Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-', '(+/-)-alpha-Pinene', 'NSC94522', 'NSC94523', 'NCGC00090682-01', '(-)-?-Pinene', '(1R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene', 'CAS-80-56-8', '(1S)-(-)-a-Pinene', 'alphapinene', 'alpha pinene', 'an alpha-pinene', 'Cyclic dexadiene', 'alpha -pinene', '4,6,6-trimethylbicyclo[3.1.1]hept-3-ene', 'Acitene A', '(-)alpha-pinene', 'a-Pinene PF', 'Pinene, .alpha.', 'alpha [D] Pinene', 'alpha [L] Pinene', '1R-.alpha.-Pinene', '(R)-.alpha.-Pinene', '? PINENE', '(1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene', 'PINENE, ALPHA (D)', 'PINENE, ALPHA (L)', '(.+/-.)-.alpha.-Pinene', 'CHEMBL442565', 'NSC7727', 'alpha-Pinene (+/-)-alpha-Pinene', 'Tox21_110996', 'Tox21_200108', 'Tox21_303385', 'NSC-94522', 'NSC-94523', 'PC 500', 'AKOS000121239', 'AB86235', 'AB86464', 'AB93066', 'DB15573', 'UN 2368', 'NCGC00090682-02', 'NCGC00257379-01', 'NCGC00257662-01', 'FP158530', 'LS-13835', '2,6-Trimethylbicyclo[3.1.1]-2-heptene', 'DB-017892', 'Bicyclo[3.1.1]hept-2-ene,6,6-trimethyl-', 'NS00067073', '2,6-Trimethylbicyclo[3.1.1]-2-hept-2-ene', 'EN300-21685', 'C09880', 'Q27104380', 'Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (.+/-.)-', '(+/-)-2-Pinene, 2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene, alpha-Pinene'] |
From Pubchem