8,8'-[Carbonylbis(Imino-3,1-Phenylenecarbonylimino)]Di(1,3,5-Naphthalenetrisulfonic Acid)
[CAS# 104869-31-0]

Identification

• Name: 8,8'-[Carbonylbis(Imino-3,1-Phenylenecarbonylimino)]Di(1,3,5-Naphthalenetrisulfonic Acid)
• Synonyms: Suramin analog; AIDS000972
• Molecular Formula: C₃₅H₂₆N₄O₂₁S₆
• Molecular Weight: 1030.99
• CAS Registry Number: 104869-31-0
• SMILES: C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C(=O)NC3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)C(=O)NC5=C6C(=CC(=CC6=C(C=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O
• InChI: 1S/C35H26N4O21S6/c40-33(38-25-7-9-27(63(49,50)51)23-13-21(61(43,44)45)15-29(31(23)25)65(55,56)57)17-3-1-5-19(11-17)36-35(42)37-20-6-2-4-18(12-20)34(41)39-26-8-10-28(64(52,53)54)24-14-22(62(46,47)48)16-30(32(24)26)66(58,59)60/h1-16H,(H,38,40)(H,39,41)(H2,36,37,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)
• InChIKey: JMONOAYAUIIKMS-UHFFFAOYSA-N

Properties

• Density: 1.9±0.1g/cm³ (Cal.)
• Refractive index: 1.797 (Cal.)