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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > 3-oxo steroid > 3-oxo-5alpha-steroid > 17beta-hydroxy-2alpha-(hydroxymethyl)-5alpha-androstan-3-one
... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 3-oxo steroid > 3-oxo-5alpha-steroid > 17beta-hydroxy-2alpha-(hydroxymethyl)-5alpha-androstan-3-one

Preferred term

17beta-hydroxy-2alpha-(hydroxymethyl)-5alpha-androstan-3-one  

Type

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

Broader concept

charge

  • 0

formula

  • C20H32O3

inchi

  • InChI=1S/C20H32O3/c1-19-8-7-16-14(15(19)5-6-18(19)23)4-3-13-9-17(22)12(11-21)10-20(13,16)2/h12-16,18,21,23H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,18-,19-,20-/m0/s1

inchikey

  • OKOKLFXLKDXQOK-VDBAHQDGSA-N

mass

  • 320.46630

monoisotopicmass

  • 320.23514

smiles

  • C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)[C@H](CO)C[C@]34C)[C@@H]1CC[C@@H]2O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79557

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