Tetrahydroaldosterone
[CAS# 13489-75-3]

Identification

• Name: Tetrahydroaldosterone
• Synonyms: 3Alpha,5Beta-Tetrahydroaldosterone; Pregnan-20-One, 11,18-Epoxy-3,18,21-Trihydroxy-, (3Alpha,5Beta,11Beta)-; Tetrahydroaldosterone
• Molecular Formula: C₂₁H₃₂O₅
• Molecular Weight: 364.48
• CAS Registry Number: 13489-75-3
• SMILES: [C@@H]1(C(CO)=O)[C@]23[C@@H](CC1)[C@H]4[C@H]([C@H](C2)OC3O)[C@]5(C)[C@H](CC4)C[C@@H](CC5)O
• InChI: 1S/C21H32O5/c1-20-7-6-12(23)8-11(20)2-3-13-14-4-5-15(16(24)10-22)21(14)9-17(18(13)20)26-19(21)25/h11-15,17-19,22-23,25H,2-10H2,1H3/t11-,12-,13+,14+,15-,17+,18-,19?,20+,21-/m1/s1
• InChIKey: JDEYOKPHRJVBQO-FPXQBPFJSA-N

Properties

• Density: 1.299g/cm³ (Cal.)
• Boiling point: 557.512°C at 760 mmHg (Cal.)
• Flash point: 195.379°C (Cal.)