Products 1304143-17-6

CAS 1304143-17-6 is the registry number for AF488 DBCO. Offered by: Biosynth. Available pack sizes: 1mg, 5mg, 25mg.

Structural formula: {0} (CAS {1})

2-(3-amino-6-imino-4,5-disulfoxanthen-9-yl)-5-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]carbamoyl]benzoic acid (CAS 1304143-17-6) is a chemical compound with the molecular formula C39H28N4O11S2 and a molecular weight of 792.8 g/mol. IUPAC name: 2-(3-amino-6-imino-4,5-disulfoxanthen-9-yl)-5-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]carbamoyl]benzoic acid. InChIKey: BNVKILBVLFUYQW-UHFFFAOYSA-N.

Identity
Molecular formulaC39H28N4O11S2
Molecular weight792.8 g/mol
IUPAC name2-(3-amino-6-imino-4,5-disulfoxanthen-9-yl)-5-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]carbamoyl]benzoic acid
InChIKeyBNVKILBVLFUYQW-UHFFFAOYSA-N
SMILESC1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCNC(=O)C4=CC(=C(C=C4)C5=C6C=CC(=N)C(=C6OC7=C5C=CC(=C7S(=O)(=O)O)N)S(=O)(=O)O)C(=O)O

Computed by PubChem (NCBI)