5,6-trans-Calcitriol
Product Code
TRC-C144510-1MG
CAS Number
Product Format
Neat
Molecular Formula
C27 H44 O3
Molecular Weight
416.64
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Product Type
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Product Information
Analyte Name
trans-Calcitriol
CAS Number
73837-24-8
Molecular Formula
C27 H44 O3
Molecular Weight
416.64
Accurate Mass
416.329
SMILES
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C\3/C[C@@H](O)C[C@H](O)C3=C)\CCC[C@]12C
InChI
InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11+/t18-,22-,23-,24+,25+,27-/m1/s1
IUPAC
(1R,3S,5E)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Storage Temperature
-86°C
Shipping Temperature
Dry ice
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
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