| 2D Structure | |
| CID | 7778 |
| Target | CYP2C9 , CYP3A4 , GLI3 , RXRA |
| IUPAC Name | 3,7-dimethyloct-6-enyl formate |
| InChI | InChI=1S/C11H20O2/c1-10(2)5-4-6-11(3)7-8-13-9-12/h5,9,11H,4,6-8H2,1-3H3 |
| InChI Key | DZNVIZQPWLDQHI-UHFFFAOYSA-N |
| Canonical SMILES | CC(CCC=C(C)C)CCOC=O |
| Isomeric SMILES | CC(CCC=C(C)C)CCOC=O |
| Molecular Formula | C11H20O2 |
| Molecular Weight | 184.27 |
| synonyms | ['Citronellyl formate', '105-85-1', '3,7-dimethyloct-6-en-1-yl formate', '6-OCTEN-1-OL, 3,7-DIMETHYL-, FORMATE', 'Formic acid, citronellyl ester', 'Citronellyl methanoate', '3,7-dimethyloct-6-enyl formate', '2,6-Dimethyl-2-octen-8-yl formate', '3,7-Dimethyl-6-octen-1-yl formate', 'FEMA No. 2314', '(1)-3,7-Dimethyloct-6-enyl formate', '3,7-Dimethyl-6-octen-1-yl methanoate', 'Formic acid, 3,7-dimethyl-6-octen-1-yl ester', '7B1MY2BRDK', 'EINECS 203-338-9', 'EINECS 300-075-2', 'NSC 46117', 'BRN 1723215', 'DTXSID1044772', 'AI3-24239', '6-Octen-1-ol, 3,7-dimethyl-, 1-formate', 'NSC-46117', 'DTXCID9024772', 'CITRONELLYL FORMATE [FCC]', 'CITRONELLYL FORMATE [FHFI]', '2-02-00-00032 (Beilstein Handbook Reference)', '(+-)-CITRONELLYL FORMATE', 'CITRONELLYL FORMATE, (+-)-', '203-338-9', 'Citronellol formate', '93919-91-6', '(+)-3,7-Dimethyloct-6-enyl formate', '(-)-3,7-Dimethyloct-6-enyl formate', 'CHEBI:31406', '93919-93-8', 'UNII-7B1MY2BRDK', 'Citronellol formate (6CI)', 'Citronelyl formate', 'EINECS 300-076-8', 'EINECS 300-078-9', 'Citronellyl formate, FCC', 'SCHEMBL416782', 'CHEMBL3184928', 'FEMA 2314', 'WLN: VHO2Y1&3UY1&1', '(+/-)-CITRONELLYL FORMATE', 'NSC46117', '3,7-Dimethyl-6-octenyl formate #', 'Tox21_301031', '6-Octen-1-ol,7-dimethyl-, formate', 'AKOS016009786', '2, 6-Dimethyl-2-octen-8-yl formate', 'CITRONELLYL FORMATE, (+/-)-', 'LMPR0102010014', 'NCGC00248262-01', 'NCGC00254933-01', '6-Octen-1-ol,3,7-dimethyl-,1-formate', 'AS-62928', 'CAS-105-85-1', 'Formic acid,7-dimethyl-6-octen-1-yl ester', 'CS-0186751', 'NS00012114', 'F88176', 'Q27114304'] |
From Pubchem