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Product Overview

Product Code

TRC-H995800

CAS Number

54573-75-0

Product Format

Neat

Molecular Formula

C28 H44 O2

Molecular Weight

412.65

API Family

Vitamin D, Doxercalciferol

Product Categories

TRC, Vitamins, Chiral Molecules , API Reference Standards & Research Materials, Vitamins and derivatives, Impurity Reference Materials , Vitamins and derivatives, Additional Neuro Products, Additional Covid-19 Research materials

Product Type

API

Drug Type

Vitamins & Derivatives

Documentation

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Product Information

Chemical Data

Analyte Name

1-Hydroxy Vitamin D2

CAS Number

54573-75-0

Molecular Formula

C28 H44 O2

Molecular Weight

412.65

Accurate Mass

412.3341

SMILES

CC(C)[C@@H](C)\C=C\[C@@H](C)[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/C28H44O2/c1-18(2)19(3)9-10-20(4)25-13-14-26-22(8-7-15-28(25,26)6)11-12-23-16-24(29)17-27(30)21(23)5/h9-12,18-20,24-27,29-30H,5,7-8,13-17H2,1-4,6H3/b10-9+,22-11+,23-12-/t19-,20+,24+,25+,26-,27-,28+/m0/s1

IUPAC

(1R,3S,5Z)-5-[(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]ethylidene]-4-methylidenecyclohexane-1,3-diol

Product Data

Storage Temperature

-86°C

Shipping Temperature

Dry ice

Country of Origin

CANADA

Product Type

API

Product Format

Neat

API Family

Vitamin D; Doxercalciferol

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Doxercalciferol

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