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Concept information

Preferred term

گاناکسولون  

Type

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

charge

  • 0

formula

  • C22H36O2

inchi

  • InChI=1S/C22H36O2/c1-14(23)17-7-8-18-16-6-5-15-13-20(2,24)11-12-21(15,3)19(16)9-10-22(17,18)4/h15-19,24H,5-13H2,1-4H3/t15-,16-,17+,18-,19-,20+,21-,22+/m0/s1

inchikey

  • PGTVWKLGGCQMBR-FLBATMFCSA-N

mass

  • 332.528

monoisotopicmass

  • 332.27153

smiles

  • O[C@]1(C[C@]2([C@@]([C@@]3([C@]([C@]4([C@](CC3)([C@H](CC4)C(=O)C)C)[H])(CC2)[H])[H])(CC1)C)[H])C

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177658

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