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Substance Name: Agelenotoxin 452
RN: 128549-98-4
InChIKey: ICSMWVXZVJFMRP-UHFFFAOYSA-N

Molecular Formula

  • C23-H44-N6-O3

Molecular Weight

  • 452.64
 
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Names and Synonyms

Results Name

  • Agelenotoxin 452

Synonyms

  • Agel 452
  • Agelenotoxin 452
  • alpha-Agatoxin AG 452

Systematic Name

  • Benzamide, N-(20-amino-4-hydroxy-4,8,12,17-tetraazaeicos-1-yl)-4-hydroxy-

Registry Numbers

CAS Registry Number

  • 128549-98-4

System Generated Number

  • 0128549984

Structure Descriptors

InChI

1S/C23H44N6O3/c24-11-3-14-25-12-1-2-13-26-15-4-16-27-17-5-19-29(32)20-6-18-28-23(31)21-7-9-22(30)10-8-21/h7-10,25-27,30,32H,1-6,11-20,24H2,(H,28,31)

InChIKey

ICSMWVXZVJFMRP-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)O)(=O)NCCC[N@@](CCCNCCCNCCCCNCCCN)O