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Substance Name: Ergoline, 6-methyl-8-((2-(1-methylethyl)-1H-imidazol-1-yl)methyl)-, (8-beta)-
RN: 105579-52-0
InChIKey: WKYAKYYYLADWNN-FBOUHOSPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N4

Molecular Weight

  • 348.4912
 
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Names and Synonyms

Synonyms

  • 6-Methyl-8-((2-(1-methylethyl)-1H-imidazol-1-yl)methyl)ergoline (8-beta)-
  • RTECS KP4116000

Systematic Name

  • Ergoline, 6-methyl-8-((2-(1-methylethyl)-1H-imidazol-1-yl)methyl)-, (8-beta)-

Registry Numbers

CAS Registry Number

  • 105579-52-0

System Generated Number

  • 0105579520

Structure Descriptors

InChI

1S/C22H28N4/c1-14(2)22-23-7-8-26(22)13-15-9-18-17-5-4-6-19-21(17)16(11-24-19)10-20(18)25(3)12-15/h4-8,11,14-15,18,20,24H,9-10,12-13H2,1-3H3/t15-,18?,20-/m1/s1

InChIKey

WKYAKYYYLADWNN-FBOUHOSPSA-N

Smiles

CC(C)c1nccn1C[C@@H]2CC3c4cccc5c4c(c[nH]5)C[C@H]3N(C2)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 640mg/kg (640mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 42, Pg. 1463, 1994.