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Substance Name: Ergoline-8-methanol, 1,6-dimethyl-10-methoxy-, 1,4-dihydro-1-methyl-3-pyridinecarboxylate (ester), (8-beta)-
RN: 113678-79-8
InChIKey: GQBLSJWBPVEWDI-SEIFXHLTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H31-N3-O3

Molecular Weight

  • 421.5379
 
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Names and Synonyms

Synonym

  • 10-Methoxy-1,6-dimethyl-8-beta-(1-methyl-1,4-dihydro-3-pyridylcarbonyloxymethyl)ergoline

Systematic Name

  • Ergoline-8-methanol, 1,6-dimethyl-10-methoxy-, 1,4-dihydro-1-methyl-3-pyridinecarboxylate (ester), (8-beta)-

Registry Numbers

CAS Registry Number

  • 113678-79-8

System Generated Number

  • 0113678798

Structure Descriptors

InChI

1S/C25H31N3O3/c1-26-10-6-7-18(14-26)24(29)31-16-17-12-25(30-4)20-8-5-9-21-23(20)19(15-27(21)2)11-22(25)28(3)13-17/h5-6,8-10,14-15,17,22H,7,11-13,16H2,1-4H3/t17-,22-,25+/m1/s1

InChIKey

GQBLSJWBPVEWDI-SEIFXHLTSA-N

Smiles

Cn1cc2c3c1cccc3[C@]4(C[C@H](CN([C@@H]4C2)C)COC(=O)C5=CN(C=CC5)C)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 800mg/kg (800mg/kg)   United States Patent Document. Vol. #4785001,