Vitamin D3-d6
Product Specifications
CAS Number
118584-54-6
Synonyms
Cholecalciferol D6; Cholecalciferol D6 (26,26,26,27,27,27-D6); Cyclohexanol, 4-methylene-3-[(2E)-2-[(1R,3aS,7aR)-octahydro-7a-methyl-1-[(1R)-1-methyl-5-(methyl-d3)hexyl-6,6,6-d3]-4H-inden-4-ylidene]ethylidene]-, (1S,3Z)-; 9,10-Secocholesta-5,7,10(19)-trien-26,26,26,27,27,27-d6-3-ol, (3β,5Z,7E)- (9CI); (1S,3Z)-4-Methylene-3-[(2E)-2-[(1R,3aS,7aR)-octahydro-7a-methyl-1-[(1R)-1-methyl-5-(methyl-d3)hexyl-6,6,6-d3]-4H-inden-4-ylidene]ethylidene]cyclohexanol; Vitamin D3-26,26,26,27,27,27-d6
Hazard Statement
No Data Available
Smiles
[2H]C([2H])([2H])C(CCC[C@@H](C)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C)C([2H])([2H])[2H]
Molecular Formula
C27 2H6 H38 O
Molecular Weight
390.67
InChI
InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-26,28H,3,6-11,14-18H2,1-2,4-5H3/b22-12+,23-13-/t21-,24+,25-,26+,27-/m1/s1/i1D3,2D3
Additionnal Information
IUPAC name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-7,7,7-trideuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol
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