| 名称 | 内容 |
|---|---|
| kegg编号 | C05467 |
| pubchemid | 7827 |
| name | 3alpha,7alpha,12alpha-Trihydroxy-5beta-24-oxocholestanoyl-CoA |
| formula | C48H78N7O21P3S |
| structure |  |
| Isomeric_Smiles | CCOCCOC(=O)C=C |
| Cannoical_Smiles | CCOCCOC(=O)C=C |
| Gotenzyme_Smiles | CC(C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O)C(=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 |
