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Substance Name: Nitroaspirin
RN: 175033-36-0
UNII: EH04H13L6B
InChIKey: IOJUJUOXKXMJNF-UHFFFAOYSA-N

Note

  • A nitric oxide donor.

Molecular Formula

  • C16-H13-N-O7

Molecular Weight

  • 331.279
 

Classification Codes

  • Analgesics
  • Analgesics, Non-Narcotic
  • Anti-Inflammatory Agents
  • Anti-Inflammatory Agents, Non-Steroidal
  • Antirheumatic Agents
  • Cardiovascular Agents
  • Cysteine Proteinase Inhibitors
  • Enzyme Inhibitors
  • Fibrin Modulating Agents
  • Fibrinolytic Agents
  • Hematologic Agents
  • Peripheral Nervous System Agents
  • Platelet Aggregation Inhibitors
  • Protease Inhibitors
  • Sensory System Agents
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Names and Synonyms

Results Name

  • Nitroaspirin

Name of Substance

  • Nitroaspirin

Synonyms

  • 2-((Nitrooxy)methyl)phenyl 2-(acetyloxy)benzoate
  • 2-Acetoxybenzoate-2-(1-nitroxymethyl)phenyl ester
  • 2-Acetoxybenzoic acid 3-nitrooxymethylphenyl ester
  • 3-(Nitroxymethyl)phenyl 2-acetoxybenzoate
  • NCX 4016
  • NCX-4016
  • Nitroaspirin
  • UNII-EH04H13L6B

Systematic Name

  • Benzoic acid, 2-(acetyloxy)-, 2-((nitrooxy)methyl)phenyl ester

Registry Numbers

CAS Registry Number

  • 175033-36-0

FDA UNII

  • EH04H13L6B

Other Registry Number

  • 190442-10-5

System Generated Number

  • 0175033360

Structure Descriptors

InChI

1S/C16H13NO7/c1-11(18)23-15-8-3-2-7-14(15)16(19)24-13-6-4-5-12(9-13)10-22-17(20)21/h2-9H,10H2,1H3

InChIKey

IOJUJUOXKXMJNF-UHFFFAOYSA-N

Smiles

c1(cc(OC(c2c(cccc2)OC(=O)C)=O)ccc1)CO[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 1076mg/kg (1076mg/kg)   Drugs of the Future. Vol. 22, Pg. 1231, 1997.
rat LD50 oral > 2gm/kg (2000mg/kg)   Drugs of the Future. Vol. 22, Pg. 1231, 1997.