ACD
Summary
| Name: | ARACHIDONIC ACID |
| Formula: | C20 H32 O2 |
| Formal charge: | 0 |
| Formula weight: | 304.467 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid |
| OpenEye OEToolkits | 1.5.0 | (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCC/C=C\C\C=C/C/C=C\C\C=C/CCCC(O)=O |
| SMILES | CACTVS | 3.341 | CCCCCC=CCC=CCC=CCC=CCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCC=CCC=CCC=CCC=CCCCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15- |
| InChIKey | InChI | 1.03 | YZXBAPSDXZZRGB-DOFZRALJSA-N |
