N1-(8,19-Dihydroxy-1-((4-isothiocyanatophenyl)amino)-9,12,20,23-tetraoxo-1-thioxo-2,8,13,19,24-pentaazanonacosan-29-yl)-N1-hydroxy-N4-(5-(N-hydroxyacetamido)pentyl)succinamide

Catalog No. :
ACHOJA540
CAS No. :
1810009-29-0
Molecular Formula :
C42H68N10O11S2
Molecular Weight :
953.20

IUPAC Name:N1-(8,19-Dihydroxy-1-((4-isothiocyanatophenyl)amino)-9,12,20,23-tetraoxo-1-thioxo-2,8,13,19,24-pentaazanonacosan-29-yl)-N1-hydroxy-N4-(5-(N-hydroxyacetamido)pentyl)succinamide

N1-(8,19-Dihydroxy-1-((4-isothiocyanatophenyl)amino)-9,12,20,23-tetraoxo-1-thioxo-2,8,13,19,24-pentaazanonacosan-29-yl)-N1-hydroxy-N4-(5-(N-hydroxyacetamido)pentyl)succinamide structure diagram
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Product Information

Product NameN1-(8,19-Dihydroxy-1-((4-isothiocyanatophenyl)amino)-9,12,20,23-tetraoxo-1-thioxo-2,8,13,19,24-pentaazanonacosan-29-yl)-N1-hydroxy-N4-(5-(N-hydroxyacetamido)pentyl)succinamide
IUPAC NameN1-(8,19-Dihydroxy-1-((4-isothiocyanatophenyl)amino)-9,12,20,23-tetraoxo-1-thioxo-2,8,13,19,24-pentaazanonacosan-29-yl)-N1-hydroxy-N4-(5-(N-hydroxyacetamido)pentyl)succinamide
Molecular FormulaC42H68N10O11S2
Molecular Weight953.20
SMILESO=C(NCCCCCN(O)C(=O)C)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=S)NC1=CC=C(N=C=S)C=C1
InChI KeyFIFURKNZUYXGMR-UHFFFAOYSA-N
Synonym5,11,16,22-Tetraazahexacosanediamide, N1-[5-(acetylhydroxyamino)pentyl]-N26,5,16-trihydroxy-N26-[5-[[[(4-isothiocyanatophenyl)amino]thioxomethyl]amino]pentyl]-4,12,15,23-tetraoxo-;N1-(8,19-Dihydroxy-1-((4-isothiocyanatophenyl)amino)-9,12,20,23-tetraoxo-1-thioxo-2,8,13,19,24-pentaazanonacosan-29-yl)-N1-hydroxy-N4-(5-(N-hydroxyacetamido)pentyl)succinamide;p-NCS-PTU-HOMO-DFOB
CAS No.1810009-29-0

Safety Data

Pictogram
FlammableToxic
Signal Word
Gefahr
Hazard Statement(s)
H228-H301
Precautionary Statement(s)
P210-P240-P241-P264-P270-P280-P301+P310+P330-P370+P378-P405-P501

Synthetic Route by SureRoute

1. ACHOJA540 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACHOJA540 route product structure diagram
    ACHOJA5401810009-29-0
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2. ACHOJA540 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. ACHOJA540 route product structure diagram
    ACHOJA5401810009-29-0
Inquiry

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