| 名称 | 内容 |
|---|---|
| kegg编号 | C17689 |
| pubchemid | 96024029 |
| name | Ursodeoxycholoyl-CoA |
| formula | C45H74N7O19P3S |
| structure |  |
| Isomeric_Smiles | CC1=CC2=C(C=C1C)[C@@H](NCC2)[C@H](C(=O)O)O |
| Cannoical_Smiles | CC1=CC2=C(C=C1C)C(NCC2)C(C(=O)O)O |
| Gotenzyme_Smiles | C[C@H](CCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C |
