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Substance Name: beta-(3-Oxo-s-triazolo)-(4,3a)-pyridin-2-yl-propionic acid
RN: 53304-46-4
InChIKey: DXVGDKXFBVHCCE-UHFFFAOYSA-N

Note

  • Supposed metabolite of TRAZODONE.

Molecular Formula

  • C9-H9-N3-O3

Molecular Weight

  • 207.1881
 
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Names and Synonyms

Name of Substance

  • beta-(3-Oxo-s-triazolo)-(4,3a)-pyridin-2-yl-propionic acid

Synonyms

  • 3-Oxo-1,2,4-triazolo(4,3-a)pyridine-2(3H)-propanoic acid
  • BRN 0614874

Systematic Name

  • 1,2,4-Triazolo(4,3-a)pyridine-2(3H)-propanoic acid, 3-oxo-

Registry Numbers

CAS Registry Number

  • 53304-46-4

System Generated Number

  • 0053304464

Structure Descriptors

InChI

1S/C9H9N3O3/c13-8(14)4-6-12-9(15)11-5-2-1-3-7(11)10-12/h1-3,5H,4,6H2,(H,13,14)

InChIKey

DXVGDKXFBVHCCE-UHFFFAOYSA-N

Smiles

c1ccn2c(c1)nn(c2=O)CCC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 943mg/kg (943mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

SKIN AND APPENDAGES (SKIN): "DERMATITIS, OTHER: AFTER SYSTEMIC EXPOSURE"

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
Yakuri to Chiryo. Pharmacology and Therapeutics. Vol. 17(Suppl,
rat LD50 oral > 5gm/kg (5000mg/kg)   Yakuri to Chiryo. Pharmacology and Therapeutics. Vol. 17(Suppl,