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Substance Name: Violamine R
RN: 10213-95-3
UNII: PE11M2TL5C
InChIKey: OOOJBBUBZCLWDE-UHFFFAOYSA-N

Molecular Formula

  • C34-H26-N2-O6-S

Molecular Weight

  • 590.653
 
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Names and Synonyms

Name of Substance

  • Violamine R

Synonym

  • UNII-PE11M2TL5C

Systematic Name

  • Xanthylium, 9-(2-carboxyphenyl)-3-((2-methylphenyl)amino)-6-((2-methyl-4-sulfophenyl)amino)-, inner salt

Registry Numbers

CAS Registry Number

  • 10213-95-3

FDA UNII

  • PE11M2TL5C

Related Registry Number

  • 6252-76-2 (mono-hydrochloride salt hydroxide inner salt)

System Generated Number

  • 0010213953

Structure Descriptors

InChI

InChI=1S/C34H26N2O6S/c1-20-7-3-6-10-29(20)35-22-11-14-27-31(18-22)42-32-19-23(36-30-16-13-24(17-21(30)2)43(39,40)41)12-15-28(32)33(27)25-8-4-5-9-26(25)34(37)38/h3-19,35-36H,1-2H3,(H-,37,38,39,40,41)

InChIKey

OOOJBBUBZCLWDE-UHFFFAOYSA-N

Smiles

Cc1ccccc1Nc2ccc3c(c4ccccc4C(=O)[O-])c5ccc(Nc6ccc(cc6C)S(=O)(=O)O)cc5[o+]c3c2