24,25-Dihydroxyvitamin D3

CAS Registry Number®

40013-87-4
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CAS Name

24,25-Dihydroxyvitamin D3

Molecular Formula

C27H44O3

Molecular Mass

416.64

Cite this Page

24,25-Dihydroxyvitamin D3.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=40013-87-4 (retrieved 2024-04-19) (CAS RN: 40013-87-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

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

InChIKey

InChIKey=FCKJYANJHNLEEP-SRLFHJKTSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 2,3-Heptanediol, 2-methyl-6-[(1R,3aS,4E,7aR)-octahydro-4-[(2Z)-2-[(5S)-5-hydroxy-2-methylenecyclohexylidene]ethylidene]-7a-methyl-1H-inden-1-yl]-, (6R)-
  • 9,10-Secocholesta-5,7,10(19)-triene-3,24,25-triol, (3β,5Z,7E)-
  • (6R)-2-Methyl-6-[(1R,3aS,4E,7aR)-octahydro-4-[(2Z)-2-[(5S)-5-hydroxy-2-methylenecyclohexylidene]ethylidene]-7a-methyl-1H-inden-1-yl]-2,3-heptanediol
  • 24,25-Dihydroxyvitamin D3
  • 24,25-Dihydroxyvitamin D

View All

Deleted or Replaced CAS Registry Numbers

99518-41-9, 41136-32-7, 49557-64-4

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