3'-(3-Oxo-11beta,17-Dihydroxy-4-Androstene-17alpha- Yl)Propionic Acid Lactone
[CAS# 51390-69-3]

Identification

• Name: 3'-(3-Oxo-11beta,17-Dihydroxy-4-Androstene-17alpha- Yl)Propionic Acid Lactone
• Synonyms: (8S,9S,10R,11S,13S,14S)-11-Hydroxy-10,13-Dimethyl-Spiro[2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-17,5'-Tetrahydrofuran]-2',3-Dione; (8S,9S,10R,11S,13S,14S)-11-Hydroxy-10,13-Dimethylspiro[2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-17,5'-Tetrahydrofuran]-2',3-Dione; (8S,9S,10R,11S,13S,14S)-11-Hydroxy-10,13-Dimethyl-Spiro[2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-17,5'-Tetrahydrofuran]-2',3-Quinone
• Molecular Formula: C₂₂H₃₀O₄
• Molecular Weight: 358.48
• CAS Registry Number: 51390-69-3
• SMILES: [C@H]35[C@H]2[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)[C@@H](O)C[C@@]3(C4(OC(=O)CC4)CC5)C
• InChI: 1S/C22H30O4/c1-20-8-5-14(23)11-13(20)3-4-15-16-6-9-22(10-7-18(25)26-22)21(16,2)12-17(24)19(15)20/h11,15-17,19,24H,3-10,12H2,1-2H3/t15-,16-,17-,19+,20-,21-,22?/m0/s1
• InChIKey: VKQZKUPABHSTTG-YKAZEBNLSA-N

Properties

• Density: 1.235g/cm³ (Cal.)
• Boiling point: 565.024°C at 760 mmHg (Cal.)
• Flash point: 198.483°C (Cal.)