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Substance Name: Ergoline, 2-chloro-6-methyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-
RN: 160730-54-1
InChIKey: BIVXBRXQKABKCJ-UJBKNGIVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-Cl-N5

Molecular Weight

  • 341.844
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 160730-54-1

System Generated Number

  • 0160730541

Structure Descriptors

InChI

1S/C18H20ClN5/c1-23-7-11(8-24-10-20-9-21-24)5-13-12-3-2-4-15-17(12)14(6-16(13)23)18(19)22-15/h2-4,9-11,13,16,22H,5-8H2,1H3/t11-,13?,16-/m1/s1

InChIKey

BIVXBRXQKABKCJ-UJBKNGIVSA-N

Smiles

CN1C[C@@H](CC2[C@H]1Cc3c4c2cccc4[nH]c3Cl)Cn5cncn5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 500mg/kg (500mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 42, Pg. 1463, 1994.