Vitamin D2 Sulfate
[CAS# 1784-46-9]

Identification

• Name: Vitamin D2 Sulfate
• Synonyms: [(1R,3Z)-3-[(2E)-2-[(1R,3As,7Ar)-7A-Methyl-1-[(E,1R,4R)-1,4,5-Trimethylhex-2-Enyl]-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylene-Cyclohexyl] Hydrogen Sulfate; [(1R,3Z)-3-[(2E)-2-[(1R,3As,7Ar)-7A-Methyl-1-[(E,1R,4R)-1,4,5-Trimethylhex-2-Enyl]-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylenecyclohexyl] Hydrogen Sulfate; [(1R,3Z)-3-[(2E)-2-[(1R,3As,7Ar)-1-[(E,2R,5R)-5,6-Dimethylhept-3-En-2-Yl]-7A-Methyl-2,3,3A,5,6,7-Hexahydro-1H-Inden-4-Ylidene]Ethylidene]-4-Methylidene-Cyclohexyl] Hydrogen Sulfate
• Molecular Formula: C₂₈H₄₄O₄S
• Molecular Weight: 476.71
• CAS Registry Number: 1784-46-9
• SMILES: [C@]13([C@H](\C(CCC1)=C\C=C\2C(CC[C@@H](O[S](=O)(=O)O)C2)=C)CC[C@@H]3[C@@H](\C=C\[C@@H](C(C)C)C)C)C
• InChI: 1S/C28H44O4S/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(14-11-21(24)4)32-33(29,30)31/h9-10,12-13,19-20,22,25-27H,4,7-8,11,14-18H2,1-3,5-6H3,(H,29,30,31)/b10-9+,23-12+,24-13-/t20-,22+,25+,26+,27-,28+/m0/s1
• InChIKey: JCNSXPADDANKHU-PNXBIAHGSA-N

Properties

• Density: 1.104g/cm³ (Cal.)