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Concept information

Preferred term

(5alpha,22S,24R) 22 hydroxyergostan 3 one  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C28H48O2

has_parent_hydride

inchi

  • InChI=1S/C28H48O2/c1-17(2)18(3)15-26(30)19(4)23-9-10-24-22-8-7-20-16-21(29)11-13-27(20,5)25(22)12-14-28(23,24)6/h17-20,22-26,30H,7-16H2,1-6H3/t18-,19+,20+,22+,23-,24+,25+,26+,27+,28-/m1/s1

inchikey

  • XGIZPVUTLMXXTK-VNSZYHACSA-N

mass

  • 416.67950

monoisotopicmass

  • 416.36543

smiles

  • [H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@]([H])([C@H](C)[C@@H](O)C[C@@H](C)C(C)C)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CCC(=O)C2

subset

  • 3_STAR

synonym EXACT

  • (22S,24R)-22-hydroxy-5alpha-ergostan-3-one
  • (5alpha,22S,24R)-22-hydroxyergostan-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:59411

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