Plomestane
[CAS# 77016-85-4]

Identification

• Name: Plomestane
• Synonyms: (9S,10S,13S,14S)-13-Methyl-10-Propargyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-3,17-Quinone; Plomestane [Usan:Inn]; 10-(2-Propynyl)Estr-4-Ene-3,17-Dione
• Molecular Formula: C₂₁H₂₆O₂
• Molecular Weight: 310.44
• CAS Registry Number: 77016-85-4
• SMILES: [C@@H]13C([C@H]2[C@](CC1)(C(=O)CC2)C)CCC4=CC(=O)CC[C@]34CC#C
• InChI: 1S/C21H26O2/c1-3-10-21-12-8-15(22)13-14(21)4-5-16-17-6-7-19(23)20(17,2)11-9-18(16)21/h1,13,16-18H,4-12H2,2H3/t16?,17-,18-,20-,21-/m0/s1
• InChIKey: JKPDEYAOCSQBSZ-DWFCFSAGSA-N