skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > 3-oxo steroid > 3-oxo-5beta-steroid > 12alpha-hydroxy-5beta-pregnane-3,20-dione
... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 3-oxo steroid > 3-oxo-5beta-steroid > 12alpha-hydroxy-5beta-pregnane-3,20-dione

Preferred term

12alpha-hydroxy-5beta-pregnane-3,20-dione  

Type

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

Broader concept

charge

  • 0

formula

  • C21H32O3

inchi

  • InChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)18(15)11-19(24)21(16,17)3/h13,15-19,24H,4-11H2,1-3H3/t13-,15+,16-,17+,18+,19+,20+,21-/m1/s1

inchikey

  • WOUWWZYKGYDVMI-PHFNMVBRSA-N

mass

  • 332.47700

monoisotopicmass

  • 332.23514

smiles

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

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79885

Download this concept: