| 名称 | 内容 |
|---|---|
| kegg编号 | C19682 |
| pubchemid | 135626150 |
| name | 3,4-Didehydroadipyl-CoA |
| formula | C27H42N7O19P3S |
| structure |  |
| Isomeric_Smiles | CCC1=NNC(=N1)[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=C(N=C43)NC(CO)C(C)C)NCC(C5=CC=CC=C5)C6=CC=CC=C6)O)O |
| Cannoical_Smiles | CCC1=NNC(=N1)C2C(C(C(O2)N3C=NC4=C(N=C(N=C43)NC(CO)C(C)C)NCC(C5=CC=CC=C5)C6=CC=CC=C6)O)O |
| Gotenzyme_Smiles | CC(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](O)C(=O)NCCC(=O)NCCSC(=O)C/C=C\CC(=O)O |
