| kegg编号 |
C17651 |
| pubchemid |
96023994 |
| name |
alpha-Phocaecholic acid |
| formula |
C24H40O6 |
| structure |
 |
| Isomeric_Smiles |
CC1=CC2=C(C=C1C)[C@H](NCC2)[C@H](CO)C3=CC=CC=C3 |
| Cannoical_Smiles |
CC1=CC2=C(C=C1C)C(NCC2)C(CO)C3=CC=CC=C3 |
| Gotenzyme_Smiles |
C[C@H](C[C@@H](O)C(=O)O)[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 |