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Substance Name: 25-Hydroxy-7-dehydrocholesterol
RN: 22145-68-2
UNII: 9A664165GR
InChIKey: JJFYNCJHSCTBPW-TVQCKQBJSA-N

Note

  • A liver X receptor modulator and 7-dehydrocholesterol metabolite.

Molecular Formula

  • C27-H44-O2

Molecular Weight

  • 400.6426
 
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Names and Synonyms

Name of Substance

  • 25-Hydroxy-7-dehydrocholesterol

Synonyms

  • 25-Hydroxy-7-dehydrocholesterol
  • 25-Hydroxy-7-dehydrocholesterol, (-)-
  • 25-Hydroxyprovitamin D3
  • 7-Dehydro-25-hydroxycholesterol
  • Cholesta-5,7-diene-3,25-diol, (3beta)-
  • Cholesta-5,7-diene-3beta,25-diol
  • UNII-9A664165GR

Registry Numbers

CAS Registry Number

  • 22145-68-2

FDA UNII

  • 9A664165GR

System Generated Number

  • 0022145682

Structure Descriptors

InChI

1S/C27H44O2/c1-18(7-6-14-25(2,3)29)22-10-11-23-21-9-8-19-17-20(28)12-15-26(19,4)24(21)13-16-27(22,23)5/h8-9,18,20,22-24,28-29H,6-7,10-17H2,1-5H3/t18-,20+,22-,23+,24+,26+,27-/m1/s1

InChIKey

JJFYNCJHSCTBPW-TVQCKQBJSA-N

Smiles

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C