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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-((4-(4-morpholinylmethyl)-1,3-dioxolan-2-yl)methyl)-
RN: 80020-23-1
InChIKey: PASPNMNFZXXSGT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-N5-O5

Molecular Weight

  • 365.3877
 
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Names and Synonyms

Synonym

  • 4-Morpholinomethyl-2-(7'-theophyllinylmethyl)-dioxolane

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-((4-(4-morpholinylmethyl)-1,3-dioxolan-2-yl)methyl)-

Registry Numbers

CAS Registry Number

  • 80020-23-1

System Generated Number

  • 0080020231

Structure Descriptors

InChI

1S/C16H23N5O5/c1-18-14-13(15(22)19(2)16(18)23)21(10-17-14)8-12-25-9-11(26-12)7-20-3-5-24-6-4-20/h10-12H,3-9H2,1-2H3

InChIKey

PASPNMNFZXXSGT-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC3OCC(O3)CN4CCOCC4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4378359,
mouse LDLo intraperitoneal 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4378359,