Vitamin D2-d3

Product Specifications

CAS Number

1217448-46-8

Synonyms

D3-Vitamin D2 (6,19,19-D3)

Hazard Statement

Toxic if swallowed; UN number: UN2811; Packing Group: II

Smiles

[2H]C(=C1CC[C@H](O)C/C/1=C(\[2H])/C=C/2\CCC[C@]3(C)[C@H](CC[C@@H]23)[C@H](C)\C=C\[C@H](C)C(C)C)[2H]

Molecular Formula

C28 2H3 H41 O

Molecular Weight

399.67

InChI

InChI=1S/C28H44O/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/h9-10,12-13,19-20,22,25-27,29H,4,7-8,11,14-18H2,1-3,5-6H3/b10-9+,23-12+,24-13-/t20-,22+,25-,26+,27-,28+/m0/s1/i4D2,13D

Additionnal Information

IUPAC name: (1S,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]-1-deuterioethylidene]-4-(dideuteriomethylidene)cyclohexan-1-ol