EIC
Summary
Name: | LINOLEIC ACID |
Synonyms: | 9,12-LINOLEIC 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 | (9Z,12Z)-octadeca-9,12-dienoic acid |
OpenEye OEToolkits | 1.5.0 | (9Z,12Z)-octadeca-9,12-dienoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCC\C=C/C\C=C/CCCCC |
SMILES_CANONICAL | CACTVS | 3.341 | CCCCC/C=C\C\C=C/CCCCCCCC(O)=O |
SMILES | CACTVS | 3.341 | CCCCCC=CCC=CCCCCCCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCC\C=C/C\C=C/CCCCCCCC(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCC=CCC=CCCCCCCCC(=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/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9- |
InChIKey | InChI | 1.03 | OYHQOLUKZRVURQ-HZJYTTRNSA-N |