Secalciferol
Product Code
TRC-S211500
CAS Number
Product Format
Neat
Molecular Formula
C27 H44 O3
Molecular Weight
416.64
API Family
SecalciferolProduct Categories
TRC, Chiral Molecules , Vitamins, Lipids, Vitamin D Receptors, Multiple Sclerosis, Sleep, Stress and Anxiety, Additional Covid-19 Research materials
Product Type
MetaboliteDocumentation
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Product Information
Chemical Data
Analyte Name
24R,25-Dihydroxyvitamin D3 (Secalciferol)
CAS Number
55721-11-4
Molecular Formula
C27 H44 O3
Molecular Weight
416.64
Accurate Mass
416.329
SMILES
C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C
InChI
InChI=1S/C27H44O3/c1-18-8-12-22(28)17-21(18)11-10-20-7-6-16-27(5)23(13-14-24(20)27)19(2)9-15-25(29)26(3,4)30/h10-11,19,22-25,28-30H,1,6-9,12-17H2,2-5H3/b20-10+,21-11-/t19-,22+,23-,24+,25-,27-/m1/s1
IUPAC
(3R,6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(5S)-5-hydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methylheptane-2,3-diol
Product Data
Storage Temperature
-86°C
Shipping Temperature
Dry ice
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
API Family