Gestadienol
[CAS# 58769-17-8]

Identification

• Name: Gestadienol
• Synonyms: (8R,9S,10R,13S,14S,17R)-17-Ethanoyl-17-Hydroxy-13-Methyl-1,2,8,9,10,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-3-One; 17-Hydroxy-19-Norpregna-4,6-Diene-3,20-Dione.; Gestadienol
• Molecular Formula: C₂₀H₂₆O₃
• Molecular Weight: 314.42
• CAS Registry Number: 58769-17-8
• SMILES: [C@@H]23C=CC1=CC(CC[C@@H]1[C@H]2CC[C@]4([C@H]3CC[C@@]4(C(C)=O)O)C)=O
• InChI: 1S/C20H26O3/c1-12(21)20(23)10-8-18-17-5-3-13-11-14(22)4-6-15(13)16(17)7-9-19(18,20)2/h3,5,11,15-18,23H,4,6-10H2,1-2H3/t15-,16+,17+,18-,19-,20-/m0/s1
• InChIKey: GDTZPEHTYWXYAR-XGXHKTLJSA-N

Properties

• Density: 1.194g/cm³ (Cal.)
• Boiling point: 503.248°C at 760 mmHg (Cal.)
• Flash point: 272.248°C (Cal.)