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Substance Name: (+-)-Gabaculine hydrochloride
RN: 59556-17-1
InChIKey: OBZFLUDUSNCZKL-UHFFFAOYSA-N

Note

  • Potent inhibitor of aminobutyrate aminotransferase from Streptomyces toyocaensis.; also inhibits a variety of PLP-dependent aminotransferases.

Classification Codes

  • Drug / Therapeutic Agent
  • Enzyme Inhibitors

Molecular Formula

  • C7-H9-N-O2.Cl-H

Molecular Weight

  • 175.614
 
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Names and Synonyms

Name of Substance

  • (+-)-Gabaculine hydrochloride

Synonyms

  • (+-)-5-Amino-1,3-cyclohexadiene-1-carboxylic acid hydrochloride
  • d,l-Gabaculine hydrochloride
  • EINECS 261-802-6

Systematic Names

  • (1)-5-Aminocyclohexa-1,3-diene-1-carboxylic acid hydrochloride
  • 1,3-Cyclohexadiene-1-carboxylic acid, 5-amino-, hydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 59556-17-1

System Generated Number

  • 0059556171

Molecular Formulas

Molecular Formula

  • C7-H9-N-O2.Cl-H

Molecular Formula Fragments

  • C7-H9-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C7H9NO2.ClH/c8-6-3-1-2-5(4-6)7(9)10;/h1-3,6H,4,8H2,(H,9,10);1H

InChIKey

OBZFLUDUSNCZKL-UHFFFAOYSA-N

Smiles

Cl.NC1CC(=CC=C1)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 87mg/kg (87mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Neuropharmacology. Vol. 21, Pg. 803, 1982.