ODD
Summary
| Name: | (10E,12Z)-OCTADECA-10,12-DIENOIC ACID |
| Synonyms: | 10-TRANS-12-CIS-OCTADECADIENOIC ACID |
| Formula: | C18 H32 O2 |
| Formal charge: | 0 |
| Formula weight: | 280.445 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (10E,12Z)-octadeca-10,12-dienoic acid |
| OpenEye OEToolkits | 1.5.0 | (10E,12Z)-octadeca-10,12-dienoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCCC\C=C\C=C/CCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCC\C=C/C=C/CCCCCCCCC(O)=O |
| SMILES | CACTVS | 3.341 | CCCCCC=CC=CCCCCCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCC\C=C/C=C/CCCCCCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCC=CC=CCCCCCCCCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-9H,2-5,10-17H2,1H3,(H,19,20)/b7-6-,9-8+ |
| InChIKey | InChI | 1.03 | GKJZMAHZJGSBKD-NMMTYZSQSA-N |
