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Substance Name: Cinnolinium, 2-(carboxymethyl)-6,7-dimethoxy-4-hydroxy-, inner salt
RN: 158631-54-0
InChIKey: VWMJENHZIRQFKT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-N2-O5

Molecular Weight

  • 264.2358
 
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Names and Synonyms

Synonym

  • 2-(Carboxymethyl)-6,7-dimethoxy-4-hydroxycinnolinium inner salt

Systematic Name

  • Cinnolinium, 2-(carboxymethyl)-6,7-dimethoxy-4-hydroxy-, inner salt

Registry Numbers

CAS Registry Number

  • 158631-54-0

System Generated Number

  • 0158631540

Structure Descriptors

InChI

1S/C12H12N2O5/c1-18-10-3-7-8(4-11(10)19-2)13-14(5-9(7)15)6-12(16)17/h3-5H,6H2,1-2H3,(H-,13,15,16,17)

InChIKey

VWMJENHZIRQFKT-UHFFFAOYSA-N

Smiles

COc1cc2c(cc1OC)n[n+](cc2O)CC(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Pharmazie. Vol. 49, Pg. 406, 1994.
mammal (species unspecified) LD50 oral > 2gm/kg (2000mg/kg)   Pharmazie. Vol. 49, Pg. 406, 1994.