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Vitamin D3-[6,19,19-d3]

General Information
Catalog: BLP-000290
CAS: 80666-48-4
Molecular Formula: C27H41D3O
Molecular Weight: 387.66
Chemical Structure
Vitamin D3-[6,19,19-d3]
Synonyms Calciol (6,19,19-d3); Cholecalciferol (6,19,19-d3); Deuterated vitamin D3; Vitamin D3(6,19,19-d3); Vitamin-D3-[D3]
IUPAC Name (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]-1-deuterioethylidene]-4-(dideuteriomethylidene)cyclohexan-1-ol
Related CAS 67-97-0 (unlabelled)
Canonical SMILES CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C
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/i3D2,13D
InChI Key QYSXJUFSXHHAJI-GLSUUORTSA-N
Purity 97% (CP); 97% atom D
Storage Store at -20°C

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