Chem
J-GLOBAL ID:200907056829708537   Nikkaji number:J647.144G

CGP-58546

3′-デメチルスタウロスポリン
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: C27H24N4O3
Molecular formula furigana: C27-H24-N4-O3
Molecular weight: 452.514
InChI: InChI=1S/C27H24N4O3/c1-27-25(32)16(28-2)11-19(34-27)30-17-9-5-3-7-13(17)21-22-15(12-29-26(22)33)20-14-8-4-6-10-18(14)31(27)24(20)23(21)30/h3-10,16,19,25,28,32H,11-12H2,1-2H3,(H,29,33)/t16-,19-,25-,27+/m1/s1
InChI key: YFYYWLWHOINTHH-FCHZLITKSA-N
SMILES: CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1O)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
Systematic name  (4):
  • (9S)-2,3,10,11,12,13-ヘキサヒドロ-10α-ヒドロキシ-9-メチル-11α-(メチルアミノ)-9β,13β-エポキシ-1H,9H-ジインドロ[1,2,3-gh:3′,2′,1′-lm]ピロロ[3,4-j][1,7]ベンゾジアゾニン-1-オン
  • (9S,10R,11R,13R)-2,3,10,11,12,13-ヘキサヒドロ-10-ヒドロキシ-9-メチル-11-(メチルアミノ)-9,13-エポキシ-1H,9H-ジインドロ[1,2,3-gh:3′,2′,1′-lm]ピロロ[3,4-j][1,7]ベンゾジアゾニン-1-オン
  • (2S,3R,4R,6R)-3-ヒドロキシ-2-メチル-4-(メチルアミノ)-29-オキサ-1,7,17-トリアザオクタシクロ[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]ノナコサ-8,10,12,14(28),15(19),20(27),21(26),22,24-ノナエン-16-オン
  • (2S,3R,4R,6R)-3-hydroxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14(28),15(19),20(27),21(26),22,24-nonaen-16-one
Other name (6):
  • 3′-デメトキシ-3′-ヒドロキシスタウロスポリン
  • 3′-Demethoxy-3′-hydroxystaurosporine
  • CGP-58546
  • (9S,10R,11R,13R)-2,3,10,11,12,13-Hexahydro-10-hydroxy-9-methyl-11-(methylamino)-9,13-epoxy-1H,9H-diindolo[1,2,3-gh:3′,2′,1′-lm]pyrrolo[3,4-j][1,7]benzodiazonine-1-one
  • 3′-Demethylstaurosporine
Show all
KEGG COMPOUND: C07349
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