1-[(3S,5R,6R,8R,9S,10R,13S,14S,16R,17R)-6-Fluoro-3,5,17-Trihydroxy-10,13,16-Trimethyl-2,3,4,6,7,8,9,11,12,14,15,16-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]Ethanone
[CAS# 3264-92-4]

Identification

• Name: 1-[(3S,5R,6R,8R,9S,10R,13S,14S,16R,17R)-6-Fluoro-3,5,17-Trihydroxy-10,13,16-Trimethyl-2,3,4,6,7,8,9,11,12,14,15,16-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]Ethanone
• Synonyms: Nsc63567
• Molecular Formula: C₂₂H₃₅FO₄
• Molecular Weight: 382.51
• CAS Registry Number: 3264-92-4
• EINECS: 221-876-2
• SMILES: [C@]4([C@]3(CC[C@@H]2[C@@]1([C@](O)(C[C@H](CC1)O)[C@H](F)C[C@H]2[C@@H]3C[C@H]4C)C)C)(O)C(C)=O
• InChI: 1S/C22H35FO4/c1-12-9-17-15-10-18(23)21(26)11-14(25)5-7-19(21,3)16(15)6-8-20(17,4)22(12,27)13(2)24/h12,14-18,25-27H,5-11H2,1-4H3/t12-,14+,15-,16+,17+,18-,19-,20+,21+,22+/m1/s1
• InChIKey: UOHQEFKIKABMNS-WSKNCWGTSA-N