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Concept information

Preferred term

3b,15b,17a-trihydroxy-pregnenone  

Type

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

Broader concept

charge

  • 0

formula

  • C21H32O4

inchi

  • InChI=1S/C21H32O4/c1-12(22)21(25)11-17(24)18-15-5-4-13-10-14(23)6-8-19(13,2)16(15)7-9-20(18,21)3/h4,14-18,23-25H,5-11H2,1-3H3/t14-,15+,16-,17+,18+,19-,20-,21-/m0/s1

inchikey

  • VWUZUCWRCBMJNW-YZUCACDQSA-N

mass

  • 348.483

monoisotopicmass

  • 348.23006

smiles

  • O[C@]1([C@@]2([C@]([C@]3([C@@]([C@@]4(C(=CC3)C[C@@H](O)CC4)C)(CC2)[H])[H])([C@H](O)C1)[H])C)C(=O)C

subset

  • 2_STAR

synonym EXACT

  • 1-[(3S,8R,9S,10R,13S,14S,15R,17R)-3,15,17-trihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173219

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