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Substance Name: Ergoline-8-acetamide, 6-propyl-, (8-beta)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (2:1)
RN: 67658-46-2
InChIKey: CSFAPYYGNPPUKR-QSDZZOHASA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C38-H50-N6-O2.C4-H6-O6

Molecular Weight

  • 772.9384
 
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Names and Synonyms

Synonym

  • (8-beta)-6-Propylergoline-8-acetamide tartrate (2:1)

Systematic Name

  • Ergoline-8-acetamide, 6-propyl-, (8-beta)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (2:1)

Registry Numbers

CAS Registry Number

  • 67658-46-2

System Generated Number

  • 0067658462

Molecular Formulas

Molecular Formula

  • C38-H50-N6-O2.C4-H6-O6

Molecular Formula Fragments

  • C38-H50-N6-O2
  • C4-H6-O6
  • COMPONENT

Structure Descriptors

InChI

1S/2C19H25N3O.C4H6O6/c2*1-2-6-22-11-12(8-18(20)23)7-15-14-4-3-5-16-19(14)13(10-21-16)9-17(15)22;5-1(3(7)8)2(6)4(9)10/h2*3-5,10,12,15,17,21H,2,6-9,11H2,1H3,(H2,20,23);1-2,5-6H,(H,7,8)(H,9,10)/t2*12-,15?,17+;1-,2-/m001/s1

InChIKey

CSFAPYYGNPPUKR-QSDZZOHASA-N

Smiles

CCCN1C[C@@H](CC2[C@H]1Cc3c[nH]c4c3c2ccc4)CC(=O)N.CCCN1C[C@@H](CC2[C@H]1Cc3c[nH]c4c3c2ccc4)CC(=O)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 9100ug/kg (9.1mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 44, Pg. 3385, 1979.