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Concept information

Preferred term

9-chloro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C23H31ClO6

inchi

  • InChI=1S/C23H31ClO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h10,16-18,27,29H,4-9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1

inchikey

  • HTJFRKHNCHTUNL-GSLJADNHSA-N

mass

  • 438.94200

monoisotopicmass

  • 438.18092

smiles

  • CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]12C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79807

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