Chemical Component Summary | |
|---|---|
| Name | Thiamine Triphosphate |
| Identifiers | [2-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate |
| Formula | C12 H20 N4 O10 P3 S |
| Molecular Weight | 505.294 |
| Type | NON-POLYMER |
| Isomeric SMILES | Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)OP(=O)(O)OP(=O)(O)O |
| InChI | InChI=1S/C12H19N4O10P3S/c1-8-11(30-7-16(8)6-10-5-14-9(2)15-12(10)13)3-4-24-28(20,21)26-29(22,23)25-27(17,18)19/h5,7H,3-4,6H2,1-2H3,(H5-,13,14,15,17,18,19,20,21,22,23)/p+1 |
| InChIKey | IWLROWZYZPNOFC-UHFFFAOYSA-O |
Chemical Details | |
|---|---|
| Formal Charge | 1 |
| Atom Count | 50 |
| Chiral Atom Count | 0 |
| Bond Count | 51 |
| Aromatic Bond Count | 11 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 511 |
| ChEMBL | CHEMBL3307173 |
| ChEBI | CHEBI:9534 |
