Aldosterone 21-Sulfate
[CAS# 52036-29-0]

Identification

• Name: Aldosterone 21-Sulfate
• Synonyms: [2-[(8S,9S,10R,11S,13R,14S,17S)-13-Formyl-11-Hydroxy-10-Methyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Hydrogen Sulfate; [2-[(8S,9S,10R,11S,13R,14S,17S)-13-Formyl-11-Hydroxy-3-Keto-10-Methyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Hydrogen Sulfate; [2-[(8S,9S,10R,11S,13R,14S,17S)-11-Hydroxy-13-Methanoyl-10-Methyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Hydrogen Sulfate
• Molecular Formula: C₂₁H₂₈O₈S
• Molecular Weight: 440.51
• CAS Registry Number: 52036-29-0
• SMILES: [C@H]24[C@H]1[C@@]([C@H](CC1)C(=O)CO[S](=O)(=O)O)(C[C@H](O)[C@@H]2[C@@]3(C(=CC(=O)CC3)CC4)C)C=O
• InChI: 1S/C21H28O8S/c1-20-7-6-13(23)8-12(20)2-3-14-15-4-5-16(18(25)10-29-30(26,27)28)21(15,11-22)9-17(24)19(14)20/h8,11,14-17,19,24H,2-7,9-10H2,1H3,(H,26,27,28)/t14-,15-,16+,17-,19+,20-,21+/m0/s1
• InChIKey: LWCMITUCQRJZGP-ZVIOFETBSA-N

Properties

• Density: 1.438g/cm³ (Cal.)