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Substance Name: (5R,8R,10R)-6-Methyl-8-(1,2,4-triazol-1-ylmethyl)ergoline
RN: 105579-47-3
InChIKey: AIBHLZVVPXCTKY-XURPUJGUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H21-N5

Molecular Weight

  • 307.3989
 
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Names and Synonyms

Name of Substance

  • (5R,8R,10R)-6-Methyl-8-(1,2,4-triazol-1-ylmethyl)ergoline

Synonyms

  • (5R,8R,10R)-6-Methyl-8-(1,2,4-triazol-1-ylmethyl)ergoline
  • 6-Methyl-8-(1H-1,2,4-triazol-1-ylmethyl)ergoline (8-beta)-
  • BAM 1110
  • BAM-1110

Systematic Name

  • Ergoline, 6-methyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-

Registry Numbers

CAS Registry Number

  • 105579-47-3

System Generated Number

  • 0105579473

Structure Descriptors

InChI

1S/C18H21N5/c1-22-8-12(9-23-11-19-10-21-23)5-15-14-3-2-4-16-18(14)13(7-20-16)6-17(15)22/h2-4,7,10-12,15,17,20H,5-6,8-9H2,1H3/t12-,15?,17-/m1/s1

InChIKey

AIBHLZVVPXCTKY-XURPUJGUSA-N

Smiles

CN1C[C@@H](CC2[C@H]1Cc3c[nH]c4c3c2ccc4)Cn5cncn5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 525mg/kg (525mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 42, Pg. 1463, 1994.