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Substance Name: 6-Iodomethylcholesterol
RN: 68232-36-0
InChIKey: QJHZPCLORSPENH-WUBXXOOBSA-N

Molecular Formula

  • C27-H45-I-O

Molecular Weight

  • 508.6515
 
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Names and Synonyms

Name of Substance

  • 6-Iodomethylcholesterol

Synonyms

  • 6beta-Iodomethyl-19-norcholesterol
  • Bimetrol
  • I-Bimetrol

Systematic Name

  • 19-Norcholest-5(10)-en-3-ol, 6-(iodo-123I-methyl)-, (3beta,6beta)-

Registry Numbers

CAS Registry Number

  • 68232-36-0

System Generated Number

  • 0068232360

Structure Descriptors

InChI

1S/C27H45IO/c1-17(2)6-5-7-18(3)25-10-11-26-24-14-19(16-28)23-15-20(29)8-9-21(23)22(24)12-13-27(25,26)4/h17-20,22,24-26,29H,5-16H2,1-4H3/t18-,19+,20+,22-,24-,25-,26+,27-/m1/s1/i28-4

InChIKey

QJHZPCLORSPENH-WUBXXOOBSA-N

Smiles

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H](C4=C3CC[C@@H](C4)O)C[123I])C