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Concept information

Preferred term

JQ1  

Type

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

alt_id

  • CHEBI:95080

charge

  • 0

formula

  • C23H25ClN4O2S

inchi

  • InChI=1S/C23H25ClN4O2S/c1-12-13(2)31-22-19(12)20(15-7-9-16(24)10-8-15)25-17(11-18(29)30-23(4,5)6)21-27-26-14(3)28(21)22/h7-10,17H,11H2,1-6H3/t17-/m0/s1

inchikey

  • DNVXATUJJDPFDM-KRWDZBQOSA-N

mass

  • 456.990

monoisotopicmass

  • 456.13867

smiles

  • C(=O)(OC(C)(C)C)C[C@H]1C=2N(C3=C(C(=N1)C4=CC=C(C=C4)Cl)C(=C(S3)C)C)C(=NN2)C

subset

  • 3_STAR

synonym EXACT

  • JQ1
  • tert-butyl [(6S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:137113

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