Vitamin D3 octanoate

For research use only. Not for therapeutic Use.

  • CAT Number: R058827
  • CAS Number: 927822-16-0
  • Molecular Formula: C35H58O2
  • Molecular Weight: 510.83
  • Purity: ≥95%
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Vitamin D3 octanoate is an octanoate ester of vitamin D3[1]. Vitamin D3 (Cholecalciferol; HY-15398) is a naturally occuring form of vitamin D. Vitamin D3 induces cell differentiation and prevents proliferation of cancer cells[2].


Catalog Number R058827
CAS Number 927822-16-0
Synonyms

[(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]ethylidene]-4-methylidenecyclohexyl] octanoate

Molecular Formula C35H58O2
Purity ≥95%
InChI InChI=1S/C35H58O2/c1-7-8-9-10-11-17-34(36)37-31-21-18-27(4)30(25-31)20-19-29-16-13-24-35(6)32(22-23-33(29)35)28(5)15-12-14-26(2)3/h19-20,26,28,31-33H,4,7-18,21-25H2,1-3,5-6H3/b29-19+,30-20-/t28-,31+,32-,33+,35-/m1/s1
InChIKey ARPKBLFKZDOQKT-MOKSJEDKSA-N
SMILES CCCCCCCC(=O)OC1CCC(=C)C(=CC=C2CCCC3(C2CCC3C(C)CCCC(C)C)C)C1
Reference

[1]. John M Ballard, et al. Degradation of vitamin D3 in a stressed formulation: the identification of esters of vitamin D3 formed by a transesterification with triglycerides. J Pharm Biomed Anal. 2007 Jan 4;43(1):142-50.
 [Content Brief]

[2]. Laura Bergadà, et al. Role of local bioactivation of vitamin D by CYP27A1 and CYP2R1 in the control of cell growth in normal endometrium and endometrial carcinoma. Lab Invest. 2014 Jun;94(6):608-22
 [Content Brief]

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