ODT
Summary
| Name: | (11E,13E,15Z)-OCTADECA-11,13,15-TRIENOIC ACID |
| Synonyms: | 11-TRANS-13-TRANS-15-CIS-OCTADECATRIENOIC 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 | (11E,13E,15Z)-octadeca-11,13,15-trienoic acid |
| OpenEye OEToolkits | 1.5.0 | (11E,13E,15Z)-octadeca-11,13,15-trienoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCCCC\C=C\C=C\C=C/CC |
| SMILES_CANONICAL | CACTVS | 3.341 | CC\C=C/C=C/C=C/CCCCCCCCCC(O)=O |
| SMILES | CACTVS | 3.341 | CCC=CC=CC=CCCCCCCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC\C=C/C=C/C=C/CCCCCCCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCC=CC=CC=CCCCCCCCCCC(=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/h3-8H,2,9-17H2,1H3,(H,19,20)/b4-3-,6-5+,8-7+ |
| InChIKey | InChI | 1.03 | ZSXWVPXJLXTOQQ-ZRGCPWHVSA-N |
