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Concept information

... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 20-oxo steroid > 3alpha,17alpha-dihydroxy-5beta-pregnan-20-one

Preferred term

3alpha,17alpha-dihydroxy-5beta-pregnan-20-one  

Type

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

alt_id

  • CHEBI:180513

charge

  • 0

formula

  • C21H34O3

inchi

  • InChI=1S/C21H34O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h14-18,23-24H,4-12H2,1-3H3/t14-,15-,16-,17+,18+,19+,20+,21+/m1/s1

inchikey

  • LKQDFQLSEHWIRK-UKBVDAKRSA-N

mass

  • 334.500

monoisotopicmass

  • 334.25079

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 3alpha,17-dihydroxy-5beta-pregnan-20-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:34353

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