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Substance Name: 1-Sulfooxy-3-methylcholanthrene
RN: 179073-71-3
UNII: D2332YU0KZ
InChIKey: GCTODDXZZNSHQO-UHFFFAOYSA-N

Molecular Weight

  • 364.4194
 
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Names and Synonyms

Name of Substance

  • 1-Sulfooxy-3-methylcholanthrene

Synonyms

  • CCRIS 7687
  • UNII-D2332YU0KZ

Systematic Name

  • 1-Sulfooxy-3-methylcholanthrene

Registry Numbers

CAS Registry Number

  • 179073-71-3

FDA UNII

  • D2332YU0KZ

System Generated Number

  • 0179073713

Structure Descriptors

InChI

1S/C21H16O4S/c1-12-6-7-14-10-18-15-5-3-2-4-13(15)8-9-16(18)21-19(25-26(22,23)24)11-17(12)20(14)21/h2-10,19H,11H2,1H3,(H,22,23,24)

InChIKey

GCTODDXZZNSHQO-UHFFFAOYSA-N

Smiles

Cc1ccc2cc3c(ccc4ccccc34)c5C(Cc1c25)OS(=O)(=O)O