| kegg编号 |
C19393 |
| pubchemid |
124490065 |
| name |
Dibenzo[a,e]pyrene |
| formula |
C24H14 |
| structure |
 |
| Isomeric_Smiles |
C[C@@H]1C[C@@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@@H](C[C@@]2([C@]1(C(=O)COC(=O)C)O)C)O)Br)C)F |
| Cannoical_Smiles |
CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C)O)C)O)Br)C)F |
| Gotenzyme_Smiles |
c1ccc2c(c1)cc1c3ccccc3c3cccc4ccc2c1c43 |