CRE
Summary
| Name: | GERMACRENE A |
| Synonyms: | 8-ISOPROPENYL-1,5-DIMETHYL-CYCLODECA-1,5-DIENE |
| Formula: | C15 H24 |
| Formal charge: | 0 |
| Formula weight: | 204.351 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (1Z,5E,8R)-1,5-dimethyl-8-(1-methylethenyl)cyclodeca-1,5-diene |
| OpenEye OEToolkits | 1.5.0 | (8R)-1,5-dimethyl-8-prop-1-en-2-yl-cyclodeca-1,5-diene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | C1(=CCCC(=CCC(\C(=C)C)CC1)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(=C)[C@@H]1CC\C(=C/CC\C(=C\C1)C)C |
| SMILES | CACTVS | 3.341 | CC(=C)[CH]1CCC(=CCCC(=CC1)C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1=CCCC(=CC[C@@H](CC1)C(=C)C)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1=CCCC(=CCC(CC1)C(=C)C)C |
| InChI | InChI | 1.03 | InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9,15H,1,5,7-8,10-11H2,2-4H3/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | XMRKUJJDDKYUHV-OAHLLOKOSA-N |
