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Substance Name: Cholest-5-ene-3,4-diol
RN: 17320-10-4
UNII: 3T705H20G7
InChIKey: CZDKQKOAHAICSF-JSAMMMMSSA-N

Molecular Formula

  • C27-H46-O2

Molecular Weight

  • 402.6584
 
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Names and Synonyms

Name of Substance

  • Cholest-5-ene-3,4-diol

Synonyms

  • (3beta,4beta)-Cholest-5-ene-3,4-diol
  • 4-Hydroxycholesterol
  • 4beta-Hydroxycholesterol
  • Cholest-5-ene-3beta,4beta-diol
  • UNII-3T705H20G7

Systematic Name

  • Cholest-5-ene-3,4-diol, (3beta,4beta)-

Registry Numbers

CAS Registry Number

  • 17320-10-4

FDA UNII

  • 3T705H20G7

System Generated Number

  • 0017320104

Structure Descriptors

InChI

1S/C27H46O2/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(29)24(28)14-16-27(23,5)22(19)13-15-26(20,21)4/h10,17-22,24-25,28-29H,6-9,11-16H2,1-5H3/t18-,19+,20-,21+,22+,24+,25-,26-,27-/m1/s1

InChIKey

CZDKQKOAHAICSF-JSAMMMMSSA-N

Smiles

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H]([C@@H]4O)O)C)C