Biodinamine vitamin D2
[CAS# 115586-24-8]

Identification

• Name: Biodinamine vitamin D2
• Synonyms: Trisodium (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-Cyclohexan-1-Ol Arsorate; Trisodium (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-1-Cyclohexanol Arsorate; Trisodium (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-Cyclohexan-1-Ol Arsorate
• Molecular Formula: C₂₈H₄₄AsNa₃O₅
• Molecular Weight: 604.54
• CAS Registry Number: 115586-24-8
• SMILES: [C@]13([C@H](\C(CCC1)=C\C=C\2C(CC[C@@H](O)C2)=C)CC[C@@H]3[C@@H](\C=C\[C@@H](C(C)C)C)C)C.O=[As]([O-])([O-])[O-].[Na+].[Na+].[Na+]
• InChI: 1S/C28H44O.AsH3O4.3Na/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(29)14-11-21(24)4;2-1(3,4)5;;;/h9-10,12-13,19-20,22,25-27,29H,4,7-8,11,14-18H2,1-3,5-6H3;(H3,2,3,4,5);;;/q;;3*+1/p-3/b10-9+,23-12+,24-13-;;;;/t20-,22+,25+,26+,27-,28+;;;;/m0..../s1
• InChIKey: CBANDPRYHCIAGZ-DKPPOKJTSA-K

Properties

• Boiling point: 504.2°C at 760 mmHg (Cal.)
• Flash point: 218.2°C (Cal.)