Chem
J-GLOBAL ID：200907041065133081   Nikkaji number：J2.282.913K

CHN-90

(2S,3R)-2-[[4-[[4-(モルホリノメチル)フェニル]エチニル]ベンゾイル]アミノ]-3-ヒドロキシブタンヒドロキシム酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C24H27N3O5
Molecular formula furigana： C24-H27-N3-O5
Molecular weight： 437.496
InChI： InChI=1S/C24H27N3O5/c1-17(28)22(24(30)26-31)25-23(29)21-10-8-19(9-11-21)3-2-18-4-6-20(7-5-18)16-27-12-14-32-15-13-27/h4-11,17,22,28,31H,12-16H2,1H3,(H,25,29)(H,26,30)/t17-,22+/m1/s1
InChI key： FQYBTYFKOHPWQT-VGSWGCGISA-N
SMILES： C[C@@H](O)[C@H](NC(=O)c1ccc(cc1)C#Cc1ccc(CN2CCOCC2)cc1)C(=NO)O
Systematic name  (4)：
  • (2S,3R)-2-[[4-[[4-(モルホリノメチル)フェニル]エチニル]ベンゾイル]アミノ]-3-ヒドロキシブタンヒドロキシム酸
  • (2S,3R)-N-ヒドロキシ-2-[[4-[[4-(モルホリノメチル)フェニル]エチニル]ベンゾイル]アミノ]-3-ヒドロキシブタンアミド
  • N-ヒドロキシ(2S,3R)-3-ヒドロキシ-2-{[4-(2-{4-[(モルホリン-4-イル)メチル]フェニル}エチニル)フェニル]ホルムアミド}ブタンイミド酸
  • N-hydroxy(2S,3R)-3-hydroxy-2-{[4-(2-{4-[(morpholin-4-yl)methyl]phenyl}ethynyl)phenyl]formamido}butanimidic acid
Other name (4)：
  • (2S,3R)-2-[[4-[[4-(Morpholinomethyl)phenyl]ethynyl]benzoyl]amino]-3-hydroxybutanehydroximic acid
  • CHIR-090
  • (2S,3R)-N-Hydroxy-2-[[4-[[4-(morpholinomethyl)phenyl]ethynyl]benzoyl]amino]-3-hydroxybutanamide
  • CHN-90
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