| kegg编号 |
C01673 |
| pubchemid |
4817 |
| name |
Calcitriol |
| formula |
C27H44O3 |
| structure |
 |
| Isomeric_Smiles |
CC1=CC=C(C=C1)C(=O)CN2C3=C(CCCC3)SC2=N |
| Cannoical_Smiles |
CC1=CC=C(C=C1)C(=O)CN2C3=C(CCCC3)SC2=N |
| Gotenzyme_Smiles |
C=C1/C(=C\C=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@@H](O)C[C@@H]1O |