X04
Summary
| Name: | (2-AMINO-4-FORMYL-5-HYDROXY-6-METHYLPYRIDIN-3-YL)METHYL DIHYDROGEN PHOSPHATE |
| Synonyms: | 6-AMINO-PYRIDOXAL-5'-PHOSPHATE |
| Formula: | C8 H11 N2 O6 P |
| Formal charge: | 0 |
| Formula weight: | 262.157 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2-amino-4-formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate |
| OpenEye OEToolkits | 1.5.0 | (2-amino-5-hydroxy-4-methanoyl-6-methyl-pyridin-3-yl)methyl dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=Cc1c(O)c(nc(N)c1COP(=O)(O)O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1nc(N)c(CO[P](O)(O)=O)c(C=O)c1O |
| SMILES | CACTVS | 3.341 | Cc1nc(N)c(CO[P](O)(O)=O)c(C=O)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c(c(c(c(n1)N)COP(=O)(O)O)C=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c(c(c(c(n1)N)COP(=O)(O)O)C=O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H11N2O6P/c1-4-7(12)5(2-11)6(8(9)10-4)3-16-17(13,14)15/h2,12H,3H2,1H3,(H2,9,10)(H2,13,14,15) |
| InChIKey | InChI | 1.03 | XHTUTGLXZYJZRY-UHFFFAOYSA-N |
