LNL
Summary
| Name: | ALPHA-LINOLENIC ACID |
| Formula: | C18 H30 O2 |
| Formal charge: | 0 |
| Formula weight: | 278.43 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid |
| OpenEye OEToolkits | 1.5.0 | (9Z)-octadeca-9,12,15-trienoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCC\C=C/C\C=C/C\C=C/CC |
| SMILES_CANONICAL | CACTVS | 3.341 | CC\C=C/C/C=C\C\C=C/CCCCCCCC(O)=O |
| SMILES | CACTVS | 3.341 | CCC=CCC=CCC=CCCCCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCC=CCC=CC\C=C/CCCCCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCC=CCC=CCC=CCCCCCCCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9- |
| InChIKey | InChI | 1.03 | DTOSIQBPPRVQHS-PDBXOOCHSA-N |
