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Substance Name: L-Isoleucine, N-(3,4-dihydro-3,3-dimethyl-1-isoquinolinyl)-
RN: 187884-89-5
InChIKey: CFSVWPQERLQYDF-AWEZNQCLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H24-N2-O2

Molecular Weight

  • 288.3886
 
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Names and Synonyms

Synonym

  • N-(3,4-Dihydro-3,3-dimethyl-1-isoquinolinyl)-L-isoleucine

Systematic Name

  • L-Isoleucine, N-(3,4-dihydro-3,3-dimethyl-1-isoquinolinyl)-

Registry Numbers

CAS Registry Number

  • 187884-89-5

System Generated Number

  • 0187884895

Structure Descriptors

InChI

1S/C17H24N2O2/c1-11(2)9-14(16(20)21)18-15-13-8-6-5-7-12(13)10-17(3,4)19-15/h5-8,11,14H,9-10H2,1-4H3,(H,18,19)(H,20,21)/t14-/m0/s1

InChIKey

CFSVWPQERLQYDF-AWEZNQCLSA-N

Smiles

CC(C)C[C@@H](C(=O)O)NC1=NC(Cc2c1cccc2)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 282mg/kg (282mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 675, 1996.