25-Hydroxyvitamin D3

CAS Registry Number®

19356-17-3
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CAS Name

25-Hydroxyvitamin D3

Molecular Formula

C27H44O2

Molecular Mass

400.64

Cite this Page

25-Hydroxyvitamin D3.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=19356-17-3 (retrieved 2024-04-19) (CAS RN: 19356-17-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1

InChIKey

InChIKey=JWUBBDSIWDLEOM-DTOXIADCSA-N

SMILES

C[C@@]12[C@](\C(=C\C=C\3/C(=C)CC[C@H](O)C3)\CCC1)(CC[C@@]2([C@@H](CCCC(C)(C)O)C)[H])[H]

Canonical SMILES

OC1CC(=CC=C2CCCC3(C)C2CCC3C(C)CCCC(O)(C)C)C(=C)CC1

Other Names for this Substance

  • 1H-Indene-1-pentanol, 4-[(2Z)-2-[(5S)-5-hydroxy-2-methylenecyclohexylidene]ethylidene]octahydro-α,α,ε,7a-tetramethyl-, (εR,1R,3aS,4E,7aR)-
  • 9,10-Secocholesta-5,7,10(19)-triene-3β,25-diol
  • 9,10-Secocholesta-5,7,10(19)-triene-3,25-diol, (3β,5Z,7E)-
  • (εR,1R,3aS,4E,7aR)-4-[(2Z)-2-[(5S)-5-Hydroxy-2-methylenecyclohexylidene]ethylidene]octahydro-α,α,ε,7a-tetramethyl-1H-indene-1-pentanol
  • 25-Hydroxycholecalciferol

View All

Deleted or Replaced CAS Registry Numbers

25631-40-7, 1384584-62-6

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