| 名称 | 内容 |
|---|---|
| kegg编号 | C00378 |
| pubchemid | 3668 |
| name | Thiamine |
| formula | C12H17N4OS |
| structure |  |
| Isomeric_Smiles | CNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)NCC4=CC(=CC=C4)I)O)O |
| Cannoical_Smiles | CNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)NCC4=CC(=CC=C4)I)O)O |
| Gotenzyme_Smiles | Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1 |
