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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dipropyl-7-methyl-8-(2-(2,3,4-trimethoxyphenyl)ethenyl)-,(E)-
RN: 147700-52-5
InChIKey: WZBXVSZNWRBPGC-ZRDIBKRKSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H30-N4-O5

Molecular Weight

  • 442.513
 
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Names and Synonyms

Synonym

  • (E)-7-Methyl-1,3-dipropyl-8-(2,3,4-trimethoxystyryl)xanthine

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dipropyl-7-methyl-8-(2-(2,3,4-trimethoxyphenyl)ethenyl)-,(E)-

Registry Numbers

CAS Registry Number

  • 147700-52-5

System Generated Number

  • 0147700525

Structure Descriptors

InChI

1S/C23H30N4O5/c1-7-13-26-21-18(22(28)27(14-8-2)23(26)29)25(3)17(24-21)12-10-15-9-11-16(30-4)20(32-6)19(15)31-5/h9-12H,7-8,13-14H2,1-6H3/b12-10+

InChIKey

WZBXVSZNWRBPGC-ZRDIBKRKSA-N

Smiles

CCCn1c2c(c(=O)n(c1=O)CCC)n(c(n2)/C=C/c3ccc(c(c3OC)OC)OC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 300mg/kg (300mg/kg)   United States Patent Document. Vol. #5543415,