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Substance Name: Benzoic acid, 5-((3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl)-2-hydroxy-3-methyl-
RN: 2947-64-0
InChIKey: HNIYZPOKRGNVEA-UHFFFAOYSA-N

Note

  • Inhibits DNA methyltransferase 1.

Molecular Formula

  • C25-H20-O9

Molecular Weight

  • 464.424
 
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Names and Synonyms

Synonyms

  • Azochromol Geranol B
  • C.I. MordantViolet 16
  • C.I.43865
  • NSC 97317
  • Omega Chrome Violet R
  • Trimethylaurintricarboxylic acid
  • Ultra Brilliant Violet R

Systematic Name

  • Benzoic acid, 5-((3-carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl)-2-hydroxy-3-methyl-

Registry Numbers

CAS Registry Number

  • 2947-64-0

System Generated Number

  • 0002947640

Structure Descriptors

InChI

1S/C25H20O9/c1-10-4-13(7-16(20(10)26)23(29)30)19(14-5-11(2)21(27)17(8-14)24(31)32)15-6-12(3)22(28)18(9-15)25(33)34/h4-9,26-27H,1-3H3,(H,29,30)(H,31,32)(H,33,34)

InChIKey

HNIYZPOKRGNVEA-UHFFFAOYSA-N

Smiles

Cc1cc(cc(c1O)C(=O)O)C(=C2C=C(C(=O)C(=C2)C(=O)O)C)c3cc(c(c(c3)C(=O)O)O)C