EC0488

Catalog No. :
ACXCWG447
CAS No. :
1059477-92-7
Molecular Formula :
C65H98N16O34S
Molecular Weight :
1679.64

IUPAC Name:N2-(4-(((2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl)amino)benzoyl)-N5-((S)-1-(((S)-4-carboxy-1-(((S)-1-(((S)-4-carboxy-1-(((S)-1-(((R)-1-carboxy-2-mercaptoethyl)amino)-1,5-dioxo-5-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)pentan-2-yl)amino)-1-oxobutan-2-yl)amino)-1,5-dioxo-5-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)pentan-2-yl)amino)-1-oxobutan-2-yl)amino)-1,5-dioxo-5-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)pentan-2-yl)-L-glutamine

EC0488 structure diagram
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Product Information

Product NameEC0488
IUPAC NameN2-(4-(((2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl)amino)benzoyl)-N5-((S)-1-(((S)-4-carboxy-1-(((S)-1-(((S)-4-carboxy-1-(((S)-1-(((R)-1-carboxy-2-mercaptoethyl)amino)-1,5-dioxo-5-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)pentan-2-yl)amino)-1-oxobutan-2-yl)amino)-1,5-dioxo-5-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)pentan-2-yl)amino)-1-oxobutan-2-yl)amino)-1,5-dioxo-5-(((2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl)amino)pentan-2-yl)-L-glutamine
Molecular FormulaC65H98N16O34S
Molecular Weight1679.64
SMILESO=C1C=2C(NC=C(CNC3=CC=C(C(N[C@@H](CCC(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CS)=O)CCC(NC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=O)CCC(O)=O)=O)CCC(NC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=O)CCC(O)=O)=O)CCC(NC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=O)C(O)=O)=O)C=C3)N2)=NC(N)=N1
InChI KeyMFUGDMCMTPUQPX-KUIZGTAOSA-N
SynonymEC0488;L-Cysteine, N-[4-[[(2-amino-3,4-dihydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-L-γ-glutamyl-N-(1-deoxy-D-glucitol-1-yl)-L-glutaminyl-L-α-glutamyl-N-(1-deoxy-D-glucitol-1-yl)-L-glutaminyl-L-α-glutamyl-N-(1-deoxy-D-glucitol-1-yl)-L-glutaminyl-
CAS No.1059477-92-7

Synthetic Route by SureRoute

1. ACXCWG447 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACXCWG447 route product structure diagram
    ACXCWG4471059477-92-7
Inquiry

2. ACXCWG447 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACXCWG447 route product structure diagram
    ACXCWG4471059477-92-7
Inquiry

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