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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-7-(3-((2-(3,4-dihydroxyphenyl)-2-hydroxyethyl)amino)propyl)-1,3-dimethyl-, monohydrochloride, (S)-
RN: 13055-83-9
InChIKey: LUVIPEVDQTWORB-PFEQFJNWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H23-N5-O5.Cl-H

Molecular Weight

  • 425.871
 
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Names and Synonyms

Synonym

  • D 1946 (+)

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-(3-((2-(3,4-dihydroxyphenyl)-2-hydroxyethyl)amino)propyl)-1,3-dimethyl-, monohydrochloride, (S)-

Registry Numbers

CAS Registry Number

  • 13055-83-9

System Generated Number

  • 0013055839

Molecular Formulas

Molecular Formula

  • C18-H23-N5-O5.Cl-H

Molecular Formula Fragments

  • C18-H23-N5-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H23N5O5.ClH/c1-21-16-15(17(27)22(2)18(21)28)23(10-20-16)7-3-6-19-9-14(26)11-4-5-12(24)13(25)8-11;/h4-5,8,10,14,19,24-26H,3,6-7,9H2,1-2H3;1H/t14-;/m1./s1

InChIKey

LUVIPEVDQTWORB-PFEQFJNWSA-N

Smiles

n1(cnc2n(c(n(c(c12)=O)C)=O)C)CCCNC[C@@H](O)c1cc(c(cc1)O)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 55mg/kg (55mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 27, Pg. 14, 1977.