N-{4-[(4-{[4-({1-Amino-8-hydroxy-3,6-disulfo-7-[(4-sulfophenyl)diazenyl]-2-naphthyl}diazenyl)benzoyl]amino}phenyl)diazenyl]-3-hydroxyphenyl}glycine
[CAS# 85721-14-8]

Identification

• Name: N-{4-[(4-{[4-({1-Amino-8-hydroxy-3,6-disulfo-7-[(4-sulfophenyl)diazenyl]-2-naphthyl}diazenyl)benzoyl]amino}phenyl)diazenyl]-3-hydroxyphenyl}glycine
• Synonyms: N-[4-[[4-[[4-[[1-amino-8-hydroxy-3,6-disulpho-7-[(4-sulphophenyl)azo]-2-naphthyl]azo]benzoyl]amino]phenyl]azo]-3-hydroxyphenyl]glycine
• Molecular Formula: C₃₇H₂₉N₉O₁₄S₃
• Molecular Weight: 919.87
• CAS Registry Number: 85721-14-8
• EINECS: 288-424-4
• SMILES: Oc6cc(ccc6N=Nc5ccc(NC(=O)c4ccc(N=Nc3c(cc2cc(c(N=Nc1ccc(cc1)S(O)(=O)=O)c(O)c2c3N)S(O)(=O)=O)S(O)(=O)=O)cc4)cc5)NCC(O)=O
• InChI: 1S/C37H29N9O14S3/c38-33-32-20(16-30(63(58,59)60)35(36(32)50)46-43-24-9-12-26(13-10-24)61(52,53)54)15-29(62(55,56)57)34(33)45-42-22-3-1-19(2-4-22)37(51)40-21-5-7-23(8-6-21)41-44-27-14-11-25(17-28(27)47)39-18-31(48)49/h1-17,39,47,50H,18,38H2,(H,40,51)(H,48,49)(H,52,53,54)(H,55,56,57)(H,58,59,60)
• InChIKey: UIZJFJWXQBPDDY-UHFFFAOYSA-N

Properties

• Density: 1.742g/cm³ (Cal.)