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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(7-methoxy-1,3-benzodioxol-5-yl)ethenyl)-, (E)-
RN: 155271-99-1
InChIKey: AURWBIGAQFCFKK-VOTSOKGWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-N4-O5

Molecular Weight

  • 384.39
 
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Names and Synonyms

Synonym

  • (E)-1,3-Diethyl-8-(3-methoxy-4,5-methylenedioxystyryl)xanthine

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(7-methoxy-1,3-benzodioxol-5-yl)ethenyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 155271-99-1

System Generated Number

  • 0155271991

Structure Descriptors

InChI

1S/C19H20N4O5/c1-4-22-17-15(18(24)23(5-2)19(22)25)20-14(21-17)7-6-11-8-12(26-3)16-13(9-11)27-10-28-16/h6-9H,4-5,10H2,1-3H3,(H,20,21)/b7-6+

InChIKey

AURWBIGAQFCFKK-VOTSOKGWSA-N

Smiles

CCn1c2c(c(=O)n(c1=O)CC)[nH]c(n2)/C=C/c3cc4c(c(c3)OC)OCO4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 100mg/kg (100mg/kg)   United States Patent Document. Vol. #5543415,