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Substance Name: 7H-Pyrrolo(3,2,1-gh)-4,7-phenanthroline, 7a,8,9,10,11,11a-hexahydro-6,8-dimethyl-, maleate, trans-
RN: 101225-51-8
InChIKey: QLYSBWQHENOBAU-UODWYTCCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-N2.C4-H4-O4

Molecular Weight

  • 356.4196
 
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Names and Synonyms

Synonym

  • trans-6,8-Dimethyl-7a,8,9,10,11,11a-hexahydro-7H-pyrrolo(3,2,1-gh)-4,7-phenanthroline maleate

Systematic Name

  • 7H-Pyrrolo(3,2,1-gh)-4,7-phenanthroline, 7a,8,9,10,11,11a-hexahydro-6,8-dimethyl-, maleate, trans-

Registry Numbers

CAS Registry Number

  • 101225-51-8

System Generated Number

  • 0101225518

Molecular Formulas

Molecular Formula

  • C16-H20-N2.C4-H4-O4

Molecular Formula Fragments

  • C16-H20-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H20N2.C4H4O4/c1-11-4-3-5-13-14-9-17-8-12-6-7-18(2,16(12)14)10-15(11)13;5-3(6)1-2-4(7)8/h6-11,13,15H,3-5H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t11?,13-,15+,18?;/m0./s1

InChIKey

QLYSBWQHENOBAU-UODWYTCCSA-N

Smiles

CC1CCC[C@@H]2[C@@H]1C=N3(C=Cc4c3c2cnc4)C.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 45mg/kg (45mg/kg) BEHAVIORAL: REGIDITY

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 29, Pg. 1061, 1986.