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Substance Name: 5alpha-Bromo-6,19-epoxycholestan-3beta-ol acetate
RN: 1258-07-7
InChIKey: YEACHZHDRMYMDK-FMSSLCCRSA-N

Molecular Formula

  • C29-H47-Br-O3

Molecular Weight

  • 523.591
 
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Names and Synonyms

Name of Substance

  • 5alpha-Bromo-6,19-epoxycholestan-3beta-ol acetate

Systematic Name

  • Cholestan-3-ol, 5-bromo-6,19-epoxy-, acetate, (3beta,5alpha,6beta)-

Registry Numbers

CAS Registry Number

  • 1258-07-7

System Generated Number

  • 0001258077

Structure Descriptors

InChI

1S/C29H47BrO3/c1-18(2)7-6-8-19(3)23-9-10-24-22-15-26-29(30)16-21(33-20(4)31)11-14-28(29,17-32-26)25(22)12-13-27(23,24)5/h18-19,21-26H,6-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26-,27-,28+,29+/m1/s1

InChIKey

YEACHZHDRMYMDK-FMSSLCCRSA-N

Smiles

Br[C@]12[C@@]3(CC[C@@H](OC(=O)C)C2)CO[C@@H]1C[C@H]1[C@@H]2CC[C@@H]([C@@]2(C)CC[C@H]31)[C@@H](CCCC(C)C)C