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Substance Name: Cholest-4-en-3-one
RN: 601-57-0
UNII: 7T94NHD99C
InChIKey: NYOXRYYXRWJDKP-GYKMGIIDSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C27-H44-O

Molecular Weight

  • 384.644
 
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Names and Synonyms

Name of Substance

  • Cholest-4-en-3-one

Synonyms

  • 3-Oxocholest-4-ene
  • Cholest-4-en-3-one
  • Cholesterone
  • delta(sup 4)-Cholestenone
  • EINECS 210-005-1
  • NSC 134926
  • NSC 63000
  • UNII-7T94NHD99C

Systematic Name

  • Cholest-4-en-3-one

Registry Numbers

CAS Registry Number

  • 601-57-0

FDA UNII

  • 7T94NHD99C

Other Registry Numbers

  • 127794-09-6
  • 378185-04-7
  • 80868-58-2

System Generated Number

  • 0000601570

Structure Descriptors

InChI

1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h17-19,22-25H,6-16H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1

InChIKey

NYOXRYYXRWJDKP-GYKMGIIDSA-N

Smiles

O=C1CC[C@@]2(C(CC[C@@H]3[C@@H]2CC[C@@]2([C@H]3CC[C@@H]2[C@@H](CCCC(C)C)C)C)=C1)C