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Substance Name: Vincamine 5-bromonicotinate
RN: 58703-79-0
InChIKey: SEFKORZDDBRVFX-YAFGAGFVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2-O3.C6-H4-Br-N-O2

Molecular Weight

  • 556.454
 
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Names and Synonyms

Results Name

  • Vincamine 5-bromonicotinate

Synonyms

  • EINECS 261-397-6
  • Vincamine 5-bromonicotinate

Systematic Names

  • Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3-alpha,14-beta,16-alpha)-, mono(5-bromo-3-pyridinecarboxylate) (salt)
  • Methyl (3alpha,14beta,16alpha)-14,15-dihydro-14-hydroxyeburnamenine-14-carboxylate, mono(5-bromonicotinate)

Registry Numbers

CAS Registry Number

  • 58703-79-0

System Generated Number

  • 0058703790

Molecular Formulas

Molecular Formula

  • C21-H26-N2-O3.C6-H4-Br-N-O2

Molecular Formula Fragments

  • C21-H26-N2-O3
  • C6-H4-Br-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26N2O3.C6H4BrNO2/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2;7-5-1-4(6(9)10)2-8-3-5/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3;1-3H,(H,9,10)/t18-,20+,21+;/m1./s1

InChIKey

SEFKORZDDBRVFX-YAFGAGFVSA-N

Smiles

c1ncc(cc1C(=O)O)Br.c12CC[N@@]3[C@@H]4c2n(c2c1cccc2)[C@@](C[C@@]4(CCC3)CC)(O)C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 843mg/kg (843mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2714486,