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Substance Name: 1-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-4,6-dihydroxy-2-methyl-, trans-
RN: 23844-69-1
InChIKey: VSSKFNRRWHWEJV-UWVGGRQHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-N-O4

Molecular Weight

  • 223.227
 
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Names and Synonyms

Synonyms

  • Acide trans-dihydroxy-4,6 methyl-2 tetrahydro-1,2,3,4 isoquinoleine carboxylique
  • Acide trans-dihydroxy-4,6 methyl-2 tetrahydro-1,2,3,4 isoquinoleine carboxylique [French]

Systematic Name

  • 1-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-4,6-dihydroxy-2-methyl-, trans-

Registry Numbers

CAS Registry Number

  • 23844-69-1

System Generated Number

  • 0023844691

Structure Descriptors

InChI

1S/C11H13NO4/c1-12-5-9(14)8-4-6(13)2-3-7(8)10(12)11(15)16/h2-4,9-10,13-14H,5H2,1H3,(H,15,16)/t9-,10-/m0/s1

InChIKey

VSSKFNRRWHWEJV-UWVGGRQHSA-N

Smiles

C1[N@@]([C@@H](c2ccc(cc2[C@H]1O)O)C(=O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Chimica Therapeutica. Vol. 4, Pg. 67, 1969.
mouse LD50 intravenous > 800mg/kg (800mg/kg)   Chimica Therapeutica. Vol. 4, Pg. 67, 1969.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Chimica Therapeutica. Vol. 4, Pg. 67, 1969.