| 名称 | 内容 |
|---|---|
| kegg编号 | C00068 |
| pubchemid | 3368 |
| name | Thiamin diphosphate |
| formula | C12H19N4O7P2S |
| structure |  |
| Isomeric_Smiles | C1=NC2=C(N=C(N=C2N1C3C(C(C(O3)COP(=O)(O)O)O)O)F)N |
| Cannoical_Smiles | C1=NC2=C(N=C(N=C2N1C3C(C(C(O3)COP(=O)(O)O)O)O)F)N |
| Gotenzyme_Smiles | Cc1ncc(C[n+]2csc(CCOP(=O)(O)OP(=O)(O)O)c2C)c(N)n1 |
