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Substance Name: Benzyl alcohol, alpha-((cyclopentylamino)methyl)-3,4-dihydroxy-
RN: 13725-09-2
InChIKey: JZFABYQAQALWIN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H19-N-O3

Molecular Weight

  • 237.297
 
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Names and Synonyms

Synonyms

  • 1,2-Benzenediol, 4-(2-(cyclopentylamino)-1-hydroxyethyl)-
  • 3-13-00-02389 (Beilstein Handbook Reference)
  • alpha-((Cyclopentylamino)methyl)-3,4-dihydroxybenzyl alcohol
  • BRN 3320932
  • Protocatechuyl alcohol, alpha-(cyclopentylaminomethyl)-
  • WIN 5591

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 13725-09-2

System Generated Number

  • 0013725092

Structure Descriptors

InChI

1S/C13H19NO3/c15-11-6-5-9(7-12(11)16)13(17)8-14-10-3-1-2-4-10/h5-7,10,13-17H,1-4,8H2

InChIKey

JZFABYQAQALWIN-UHFFFAOYSA-N

Smiles

c1(cc(c(O)cc1)O)[C@@H](CNC1CCCC1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 53mg/kg (53mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 97, Pg. 14, 1949.