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Substance Name: 2,4(1H,3H)-Pyrimidinedione, 1-((6-methylergolin-8-yl)methyl)-, N(sup 6)-oxide, (8-beta)-
RN: 121550-30-9
InChIKey: FVCDYYOIIAFIEM-RTOCZJPTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N4-O3

Molecular Weight

  • 366.4188
 
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Names and Synonyms

Synonyms

  • (8-beta)-1-((6-Methylergolin-8-yl)methyl)-2,4(1H,3H)-pyrimidinedione N(sup 6)-oxide
  • 1-((6-Methylergolin-8-beta-yl)methyl)-2,4(1H,3H)-dihydropyrimidinedione N6-oxide

Systematic Name

  • 2,4(1H,3H)-Pyrimidinedione, 1-((6-methylergolin-8-yl)methyl)-, N(sup 6)-oxide, (8-beta)-

Registry Numbers

CAS Registry Number

  • 121550-30-9

System Generated Number

  • 0121550309

Structure Descriptors

InChI

1S/C20H22N4O3/c1-24(27)11-12(10-23-6-5-18(25)22-20(23)26)7-15-14-3-2-4-16-19(14)13(9-21-16)8-17(15)24/h2-6,9,12,15,17,21H,7-8,10-11H2,1H3,(H,22,25,26)/t12-,15+,17+,24?/m0/s1

InChIKey

FVCDYYOIIAFIEM-RTOCZJPTSA-N

Smiles

CN1(=O)C[C@@H](C[C@H]2[C@H]1Cc3c[nH]c4c3c2ccc4)Cn5ccc(=O)[nH]c5=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 800mg/kg (800mg/kg)   United States Patent Document. Vol. #4859678,