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Product Overview

Product Code

TRC-D499480

CAS Number

40013-87-4

Product Format

Neat

Molecular Formula

C27 H44 O3

Molecular Weight

416.637

Product Categories

TRC

Product Type

Impurity

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Product Information

Chemical Data

Analyte Name

24,25-Dihydroxycholecalciferol

CAS Number

40013-87-4

Molecular Formula

C27 H44 O3

Molecular Weight

416.637

Accurate Mass

416.329

SMILES

C[C@H](CCC(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

(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

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Chemical Data

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24, 25-​Dihydroxy VD3

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