| Phytochemical Name : (1R,2R)-1-hydroxypropane-1,2,3-tricarboxylic acid |
| PCNDIDOT0086 |
| Pubchem CID : 439238 |
| Molecular formula: C6H8O7 |
| Canonical SMILES : C(C(C(C(=O)O)O)C(=O)O)C(=O)O |
Synonymes : L-erythro-isocitric acid|(1R,2R)-Isocitric acid|(1R,2R)-1-hydroxypropane-1,2,3-tricarboxylic acid|1187-17-3|(-)-erythro-form|L-Alloisocitric acid|(-)-Alloisocitric acid|CHEBI:43291|3-carboxy-3,4-dideoxy-D-erythro-pentaric acid|Q27104505 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : -0.060 |
| Log Po/w (XLOGP3) : -1.800 |
| Log Po/w (WLOGP) : -1.390 |
| Log Po/w (MLOGP) : -1.480 |
| Log Po/w (SILICOS-IT) : -1.610 |
| Consensus Log Po/w : -1.270 |