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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > hydroxy steroid > 21-hydroxy steroid > 11b,21-dihydroxy-5b-pregnane-3,20-dione
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy steroid > 21-hydroxy steroid > 11b,21-dihydroxy-5b-pregnane-3,20-dione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > hydroxy steroid > 21-hydroxy steroid > 11b,21-dihydroxy-5b-pregnane-3,20-dione
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > 21-hydroxy steroid > 11b,21-dihydroxy-5b-pregnane-3,20-dione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > 21-hydroxy steroid > 11b,21-dihydroxy-5b-pregnane-3,20-dione
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > 21-hydroxy steroid > 11b,21-dihydroxy-5b-pregnane-3,20-dione
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > hydroxy steroid > 21-hydroxy steroid > 11b,21-dihydroxy-5b-pregnane-3,20-dione

Preferred term

11b,21-dihydroxy-5b-pregnane-3,20-dione  

Type

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

Broader concept

charge

  • 0

formula

  • C21H32O4

inchi

  • InChI=1S/C21H32O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12,14-17,19,22,24H,3-11H2,1-2H3/t12-,14+,15+,16?,17+,19-,20+,21+/m1/s1

inchikey

  • CTTOFMJLOGMZRN-MGXYISIMSA-N

mass

  • 348.483

monoisotopicmass

  • 348.23006

smiles

  • O[C@@H]1[C@]2([C@]([C@]3([C@](C1)(C(CC3)C(=O)CO)C)[H])(CC[C@]4([C@@]2(CCC(=O)C4)C)[H])[H])[H]

subset

  • 2_STAR

synonym EXACT

  • (5R,8S,9S,10S,11S,13S,14S)-11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173194

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