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Substance Name: Ergoline-8-methanol, 9,10-didehydro-1-(1,1-dimethylethyl)-6-methyl-, (8-beta)-
RN: 113702-01-5
InChIKey: IOVBIZFHKHJTIA-AUUYWEPGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H26-N2-O

Molecular Weight

  • 310.4384
 
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Names and Synonyms

Synonyms

  • (8-beta)-9,10-Didehydro-1-(1,1-dimethylethyl)-6-methylergoline-8-methanol
  • 1-(t-Butyl)-9,10-didehydro-6-methyl-8-beta-hydroxymethylergoline

Systematic Name

  • Ergoline-8-methanol, 9,10-didehydro-1-(1,1-dimethylethyl)-6-methyl-, (8-beta)-

Registry Numbers

CAS Registry Number

  • 113702-01-5

System Generated Number

  • 0113702015

Structure Descriptors

InChI

1S/C20H26N2O/c1-3-4-8-22-12-15-10-19-17(9-14(13-23)11-21(19)2)16-6-5-7-18(22)20(15)16/h5-7,9,12,14,19,23H,3-4,8,10-11,13H2,1-2H3/t14-,19-/m1/s1

InChIKey

IOVBIZFHKHJTIA-AUUYWEPGSA-N

Smiles

CCCCn1cc2c3c1cccc3C4=C[C@H](CN([C@@H]4C2)C)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 800mg/kg (800mg/kg)   United States Patent Document. Vol. #4843073,