4-((S)-2-((S)-1-(L-asparaginyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)benzyl ((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate 2,2,2-trifluoroacetate

Catalog No. :
ACENUT108
CAS No. :
2893871-67-3
Molecular Formula :
C63H97F3N10O15
Molecular Weight :
1291.52

IUPAC Name:4-((S)-2-((S)-1-(L-asparaginyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)benzyl ((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate 2,2,2-trifluoroacetate

4-((S)-2-((S)-1-(L-asparaginyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)benzyl ((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate 2,2,2-trifluoroacetate structure diagram
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Product Information

Product Name4-((S)-2-((S)-1-(L-asparaginyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)benzyl ((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate 2,2,2-trifluoroacetate
IUPAC Name4-((S)-2-((S)-1-(L-asparaginyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)benzyl ((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate 2,2,2-trifluoroacetate
Molecular FormulaC63H97F3N10O15
Molecular Weight1291.52
SMILESCC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@H](C)[C@@H](O)C1=CC=CC=C1)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C(=O)OCC1=CC=C(NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](N)CC(N)=O)C(C)C)C=C1)C(C)C.O=C(O)C(F)(F)F
InChI KeyYJEOYBSNSJPQHG-YMRSECHSSA-N
CAS No.2893871-67-3

Synthetic Route by SureRoute

1. ACENUT108 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACENUT108 route product structure diagram
    ACENUT1082893871-67-3
Inquiry

2. ACENUT108 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACENUT108 route product structure diagram
    ACENUT1082893871-67-3
Inquiry

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