| 名称 | 内容 |
|---|---|
| kegg编号 | C02615 |
| pubchemid | 5600 |
| name | (S)-Mandelonitrile |
| formula | C8H7NO |
| structure |  |
| Isomeric_Smiles | C1=CC(=CC(=C1)C(=O)NCC(=O)NCCCCC(C(=O)O)NC(=O)OCC2=CC=C(C=C2)C(F)(F)F)C(=O)NCC(=O)NCCCCC(C(=O)O)NC(=O)OCC3=CC=C(C=C3)C(F)(F)F |
| Cannoical_Smiles | C1=CC(=CC(=C1)C(=O)NCC(=O)NCCCCC(C(=O)O)NC(=O)OCC2=CC=C(C=C2)C(F)(F)F)C(=O)NCC(=O)NCCCCC(C(=O)O)NC(=O)OCC3=CC=C(C=C3)C(F)(F)F |
| Gotenzyme_Smiles | N#C[C@@H](O)c1ccccc1 |
