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Substance Name: 2,3-Dihydroxycholestan-6-one
RN: 7674-80-8
InChIKey: KIKODPSBQXENPH-MHYRXDJVSA-N

Molecular Formula

  • C27-H46-O3

Molecular Weight

  • 418.6574
 
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Names and Synonyms

Name of Substance

  • 2,3-Dihydroxycholestan-6-one

Synonym

  • 2alpha,3alpha-Dihydroxy-5alpha-cholestan-6-one

Systematic Name

  • Cholestan-6-one, 2,3-dihydroxy-, (2beta,3beta,5beta)-

Registry Numbers

CAS Registry Number

  • 7674-80-8

System Generated Number

  • 0007674808

Structure Descriptors

InChI

1S/C27H46O3/c1-16(2)7-6-8-17(3)19-9-10-20-18-13-23(28)22-14-24(29)25(30)15-27(22,5)21(18)11-12-26(19,20)4/h16-22,24-25,29-30H,6-15H2,1-5H3/t17-,18+,19-,20+,21+,22+,24-,25+,26-,27-/m1/s1

InChIKey

KIKODPSBQXENPH-MHYRXDJVSA-N

Smiles

[C@]12([C@@H]3[C@H]([C@H]4[C@@]([C@H](CC4)[C@@H](CCCC(C)C)C)(CC3)C)CC(=O)[C@@H]1C[C@H]([C@H](C2)O)O)C