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5-((((6R,7R)-2-((Acetoxymethoxy)carbonyl)-7-(2-(7-(butyryloxy)-6-chloro-2-oxo-2H-chromene-3-carboxamido)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl)thio)-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate

Catalog No. :
ACTTHP002
CAS No. :
183736-69-8
Molecular Formula :
C51H40ClN3O18S2
Molecular Weight :
1082.47

IUPAC Name:5-((((6R,7R)-2-((acetoxymethoxy)carbonyl)-7-(2-(7-(butyryloxy)-6-chloro-2-oxo-2H-chromene-3-carboxamido)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl)thio)-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate

5-((((6R,7R)-2-((Acetoxymethoxy)carbonyl)-7-(2-(7-(butyryloxy)-6-chloro-2-oxo-2H-chromene-3-carboxamido)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl)thio)-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate structure diagram
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Product Information

Product Name5-((((6R,7R)-2-((Acetoxymethoxy)carbonyl)-7-(2-(7-(butyryloxy)-6-chloro-2-oxo-2H-chromene-3-carboxamido)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl)thio)-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate
IUPAC Name5-((((6R,7R)-2-((acetoxymethoxy)carbonyl)-7-(2-(7-(butyryloxy)-6-chloro-2-oxo-2H-chromene-3-carboxamido)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl)thio)-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate
Molecular FormulaC51H40ClN3O18S2
Molecular Weight1082.47
SMILESO=C(C(N12)=C(CSC3=CC4=C(C5(C6=C(OC7=C5C=CC(OC(C)=O)=C7)C=C(OC(C)=O)C=C6)OC4=O)C=C3)CS[C@]2([H])[C@H](NC(CNC(C8=CC9=CC(Cl)=C(OC(CCC)=O)C=C9OC8=O)=O)=O)C1=O)OCOC(C)=O
InChI KeyCGSFXVJOWDKSJC-PCZUCLNZSA-N
Synonym5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[[3',6'-bis(acetyloxy)-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl]thio]methyl]-7-[[2-[[[6-chloro-2-oxo-7-(1-oxobutoxy)-2H-1-benzopyran-3-yl]carbonyl]amino]acetyl]amino]-8-oxo-, (acetyloxy)methyl ester, (6R,7R)-
CAS No.183736-69-8

Synthetic Route by SureRoute

1. ACTTHP002 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACGHDM927 route compound structure diagram
    ACGHDM92713398-11-3 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACTTHP002 route product structure diagram
    ACTTHP002183736-69-8
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2. ACTTHP002 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACVOAI694 route compound structure diagram
    ACVOAI694625-56-9 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACTTHP002 route product structure diagram
    ACTTHP002183736-69-8
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