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Concept information

... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > monocarboxylic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > monocarboxylic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > monocarboxylic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxide > oxoanion > carboxylic acid anion > monocarboxylic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > monocarboxylic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > monocarboxylic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > carbohydrate acid derivative anion > beta-d-glucosiduronate > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > carbohydrate acid derivative anion > beta-d-glucosiduronate > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > carbohydrate acid derivative anion > beta-d-glucosiduronate > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)

Preferred term

5alpha-androstane-3beta,17beta-diol 17-o-(beta-d-glucuronide)(1-)  

Type

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

charge

  • -1

formula

  • C25H39O8

inchi

  • InChI=1S/C25H40O8/c1-24-9-7-13(26)11-12(24)3-4-14-15-5-6-17(25(15,2)10-8-16(14)24)32-23-20(29)18(27)19(28)21(33-23)22(30)31/h12-21,23,26-29H,3-11H2,1-2H3,(H,30,31)/p-1/t12-,13-,14-,15-,16-,17-,18-,19-,20+,21-,23+,24-,25-/m0/s1

inchikey

  • ZJYZOWMDMWQJIV-JKNXCXBISA-M

mass

  • 467.573

monoisotopicmass

  • 467.26504

smiles

  • C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(C[C@H](C1)O)[H])[H])(CC[C@@H]4O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)[O-])O)O)O)[H])C)[H])C

subset

  • 3_STAR

synonym EXACT

  • 3beta-hydroxy-5alpha-androstan-17beta-yl beta-D-glucopyranosiduronate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:136981

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