5-(((2S,5S)-6-Amino-1-((carboxymethyl)amino)-5-(methyldisulfaneyl)-1-oxohexan-2-yl)carbamoyl)-2-(3,6-bis(dimethylamino)xanthylium-9-yl)benzoate

Catalog No. :
ACLGLB677
CAS No. :
1358755-72-2
Molecular Formula :
C34H39N5O7S2
Molecular Weight :
693.85

IUPAC Name:5-(((2S,5S)-6-amino-1-((carboxymethyl)amino)-5-(methyldisulfaneyl)-1-oxohexan-2-yl)carbamoyl)-2-(6-(dimethylamino)-3-(dimethyliminio)-3H-xanthen-9-yl)benzoate

5-(((2S,5S)-6-Amino-1-((carboxymethyl)amino)-5-(methyldisulfaneyl)-1-oxohexan-2-yl)carbamoyl)-2-(3,6-bis(dimethylamino)xanthylium-9-yl)benzoate structure diagram
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Product Information

Product Name5-(((2S,5S)-6-Amino-1-((carboxymethyl)amino)-5-(methyldisulfaneyl)-1-oxohexan-2-yl)carbamoyl)-2-(3,6-bis(dimethylamino)xanthylium-9-yl)benzoate
IUPAC Name5-(((2S,5S)-6-amino-1-((carboxymethyl)amino)-5-(methyldisulfaneyl)-1-oxohexan-2-yl)carbamoyl)-2-(6-(dimethylamino)-3-(dimethyliminio)-3H-xanthen-9-yl)benzoate
Molecular FormulaC34H39N5O7S2
Molecular Weight693.85
SMILESC([O-])(=O)C1=C(C=2C3=C([O+]=C4C2C=CC(N(C)C)=C4)C=C(N(C)C)C=C3)C=CC(C(N[C@H](C(NCC(O)=O)=O)CC[C@H](SSC)CN)=O)=C1
InChI KeyBOGATWATCMOJRX-CUNXSJBXSA-N
CAS No.1358755-72-2

Synthetic Route by SureRoute

1. ACLGLB677 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACLGLB677 route product structure diagram
    ACLGLB6771358755-72-2
Inquiry

2. ACLGLB677 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACLGLB677 route product structure diagram
    ACLGLB6771358755-72-2
Inquiry

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