7-(Carboxyethylthio)Progesterone
[CAS# 40845-01-0]

Identification

• Name: 7-(Carboxyethylthio)Progesterone
• Synonyms: 3-[[(7R,10R,13S,17S)-17-Acetyl-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-7-Yl]Thio]Propanoic Acid; 3-[[(7R,10R,13S,17S)-17-Acetyl-3-Keto-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-7-Yl]Thio]Propionic Acid; 3-[[(7R,10R,13S,17S)-17-Ethanoyl-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-7-Yl]Sulfanyl]Propanoic Acid
• Molecular Formula: C₂₄H₃₄O₄S
• Molecular Weight: 418.59
• CAS Registry Number: 40845-01-0
• SMILES: [C@]34(C(C2C([C@@]1(C(=CC(=O)CC1)C[C@H]2SCCC(=O)O)C)CC3)CC[C@@H]4C(=O)C)C
• InChI: 1S/C24H34O4S/c1-14(25)17-4-5-18-22-19(7-10-24(17,18)3)23(2)9-6-16(26)12-15(23)13-20(22)29-11-8-21(27)28/h12,17-20,22H,4-11,13H2,1-3H3,(H,27,28)/t17-,18?,19?,20-,22?,23+,24-/m1/s1
• InChIKey: BOJZZBMFGDYFER-IETBCCMDSA-N

Properties

• Density: 1.21g/cm³ (Cal.)
• Boiling point: 599.267°C at 760 mmHg (Cal.)
• Flash point: 316.226°C (Cal.)