Details of Calocinin
| IUPAC | (2S,3S,4R,6R)-6-[[(10R,13R,14S,17S)-14-hydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyloxane-3,4-diol |
| Canonical Smiles | C[C@H]1[C@H]([C@@H](C[C@@H](O1)OC2CC[C@@]3(C4CC[C@@]5([C@H](CC[C@@]5(C4CC=C3C2)O)C(C)O)C)C)O)O |
| Inchi | OONXNTUZEDPBLV-NBEUKELOSA-N |
| PubChem ID | 189455 |
| Smiles | CC(O)[C@H]1CC[C@]2(O)C3CC=C4CC(O[C@H]5C[C@@H](O)[C@H](O)[C@H](C)O5)CC[C@]4(C)C3CC[C@]12C |
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| Class | Pregnane steroids, Pachysanane triterpenoids |
| Super Class | Steroids |
| Pathways | Terpenoids |