KW 2149

Catalog No. :
ACBCBA199
CAS No. :
118359-59-4
Molecular Formula :
C24H34N6O8S2
Molecular Weight :
598.70

IUPAC Name:(2-((2-(((1aS,8S,8aR,8bS)-8-((carbamoyloxy)methyl)-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl)amino)ethyl)disulfaneyl)ethyl)-L-glutamine

KW 2149 structure diagram
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Product Information

Product NameKW 2149
IUPAC Name(2-((2-(((1aS,8S,8aR,8bS)-8-((carbamoyloxy)methyl)-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl)amino)ethyl)disulfaneyl)ethyl)-L-glutamine
Molecular FormulaC24H34N6O8S2
Molecular Weight598.70
SMILESCO[C@@]12[C@H](COC(N)=O)C3=C(C(=O)C(C)=C(NCCSSCCN[C@@H](CCC(N)=O)C(=O)O)C3=O)N1C[C@@H]1N[C@@H]12
InChI KeyWAPQQYLIKWNWHP-CYUGEGSCSA-N
SynonymKW 2149;(1aS)-8β-[(Aminocarbonyloxy)methyl]-6-[[2-[(2-L-γ-glutamylaminoethyl)dithio]ethyl]amino]-1,1aα,2,8,8a,8bα-hexahydro-8aα-methoxy-5-methylazirino[2',3':3,4]pyrrolo[1,2-a]indole-4,7-dione;KT-6149;L-Glutamine, N-[2-[[2-[[(1aS,8S,8aR,8bS)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]amino]ethyl]dithio]ethyl]-
CAS No.118359-59-4

Synthetic Route by SureRoute

1. ACBCBA199 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACBCBA199 route product structure diagram
    ACBCBA199118359-59-4
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2. ACBCBA199 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACBCBA199 route product structure diagram
    ACBCBA199118359-59-4
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