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Substance Name: WIN 5596
RN: 108873-53-6
InChIKey: VBEZGGRFZLEUGX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H21-N-O3

Molecular Weight

  • 239.313
 
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Names and Synonyms

Results Name

  • WIN 5596

Synonyms

  • 3,4-Dihydroxy-alpha-((pentylamino)methyl)benzyl alcohol
  • 3-13-00-02388 (Beilstein Handbook Reference)
  • BRN 3307433
  • Protocatechuyl alcohol, alpha-(pentylaminomethyl)-
  • WIN 5596

Systematic Name

  • Benzyl alcohol, 3,4-dihydroxy-alpha-((pentylamino)methyl)-

Registry Numbers

CAS Registry Number

  • 108873-53-6

System Generated Number

  • 0108873536

Structure Descriptors

InChI

1S/C13H21NO3/c1-2-3-4-7-14-9-13(17)10-5-6-11(15)12(16)8-10/h5-6,8,13-17H,2-4,7,9H2,1H3

InChIKey

VBEZGGRFZLEUGX-UHFFFAOYSA-N

Smiles

c1(cc(c(O)cc1)O)[C@@H](CNCCCCC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 36mg/kg (36mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 97, Pg. 14, 1949.