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Substance Name: Sodium aristolate 1
RN: 10190-99-5
UNII: KTM3D3H78E
InChIKey: BQVOPWJSBBMGBR-UHFFFAOYSA-M

Molecular Formula

  • C17-H11-N-O7.Na

Molecular Weight

  • 363.256
 
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Names and Synonyms

Results Name

  • Sodium aristolate 1

Name of Substance

  • Sodium aristolochate

Synonyms

  • CCRIS 6498
  • EINECS 233-463-4
  • UNII-KTM3D3H78E

Systematic Names

  • Sodium 8-methoxy-6-nitrophenanthro(3,4-d)-1,3-dioxole-5-carboxylate
  • Sodium aristolate 1

Registry Numbers

CAS Registry Number

  • 10190-99-5

FDA UNII

  • KTM3D3H78E

System Generated Number

  • 0010190995

Molecular Formulas

Molecular Formula

  • C17-H11-N-O7.Na

Molecular Formula Fragments

  • C17-H11-N-O7
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C17H11NO7.Na/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13;/h2-6H,7H2,1H3,(H,19,20);/q;+1/p-1

InChIKey

BQVOPWJSBBMGBR-UHFFFAOYSA-M

Smiles

[Na+].COc1cccc2c1cc(c3c(cc4OCOc4c23)C(=O)[O-])[N+](=O)[O-]