EAH
Summary
| Name: | (5S,7E,9E,11Z,14Z)-5-hydroxyicosa-7,9,11,14-tetraenoic acid |
| Formula: | C20 H32 O3 |
| Formal charge: | 0 |
| Formula weight: | 320.466 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (5S,7E,9E,11Z,14Z)-5-hydroxyicosa-7,9,11,14-tetraenoic acid |
| OpenEye OEToolkits | 1.5.0 | (5S,9E,11Z,14Z)-5-hydroxyicosa-7,9,11,14-tetraenoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCCC(O)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@@H](O)CCCC(O)=O |
| SMILES | CACTVS | 3.341 | CCCCCC=CCC=CC=CC=CC[CH](O)CCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCC\C=C/C\C=C/C=C/C=CC[C@H](CCCC(=O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCC=CCC=CC=CC=CCC(CCCC(=O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-14,19,21H,2-5,8,15-18H2,1H3,(H,22,23)/b7-6-,10-9-,12-11+,14-13+/t19-/m1/s1 |
| InChIKey | InChI | 1.03 | DVGDBDLZYCUGNU-LBIUVHPXSA-N |
