Vondacel Brown S

Molecular Formula: C₄₆H₃₀N₁₀Na₄O₁₃S₃

InChI: InChI=1/C46H34N10O13S3.4Na/c1-23-18-36(42(48)44(41(23)47)56-50-28-12-8-25(9-13-28)24-6-10-27(11-7-24)49-51-29-14-16-37(57)33(21-29)46(59)60)54-53-35-22-32-26(19-39(35)71(64,65)66)20-40(72(67,68)69)43(45(32)58)55-52-34-15-17-38(70(61,62)63)31-5-3-2-4-30(31)34;;;;/h2-22,49,52H,47-48H2,1H3,(H,59,60)(H,61,62,63)(H,64,65,66)(H,67,68,69);;;;/q;4*+1/p-4/b51-29+,54-53+,55-43+,56-50+;;;;/fC46H30N10O13S3.4Na/q-4;4m

InChIKey: InChIKey=GDQQXAPSVIPGCP-CBNGATJCDM
SMILES: CC1=CC(=C(C(=C1N)N=NC2=CC=C(C=C2)C3=CC=C(C=C3)NN=C4C=CC(=O)C(=C4)C(=O)[O-])N)N=NC5=C(C=C6C=C(C(=NNC7=CC=C(C8=CC=CC=C87)S(=O)(=O)[O-])C(=O)C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Names:
    Chocolate EMBL
    Diazol cutch FB
    Diazol cutch F
    Direct Brown BS
    Direct Brown B
    Direct Brown FS
    Direct Brown 3B
    Fixanol Brown LF
    tetrasodium (3E)-3-[[4-[4-[2,6-diamino-3-methyl-5-[(7E)-8-oxo-3,6-disulfonato-7-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalen-2-yl]diazenyl-phenyl]diazenylphenyl]phenyl]hydrazinylidene]-6-oxo-cyclohexa-1,4-diene-1-carboxylate
    Triazol Brown B
    Vondacel Brown S

Registries:
    PubChem CID 9570109
    PubChem ID 160264