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Substance Name: A 62198
RN: 117978-26-4
InChIKey: KYZQHPHXYFTWRL-UHFFFAOYSA-N

Molecular Formula

  • C30-H44-N8-O5

Molecular Weight

  • 596.7286
 
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Names and Synonyms

Name of Substance

  • A 62198

Synonyms

  • A-62198
  • Dimethylacetyl-phe-his-nhch(cyclohexylmethyl)CH(OH)CH(OH)CH2N3

Systematic Names

  • L-Arabinitol, 5-azido-1-cyclohexyl-1,2,5-trideoxy-2-((N-(N-(2-methyl-1-oxopropyl)-L-phenylalanyl)-L-histidyl)amino)-
  • Pentitol, 5-azido-1-cyclohexyl-1,2,5-trideoxy-2-((N-(N-(2-methyl-1-oxopropyl)-L-phenylalanyl)-L-histidyl)amino)-

Registry Numbers

CAS Registry Number

  • 117978-26-4

System Generated Number

  • 0117978264

Structure Descriptors

InChI

1S/C30H44N8O5/c1-19(2)28(41)36-24(14-21-11-7-4-8-12-21)29(42)37-25(15-22-16-32-18-33-22)30(43)35-23(13-20-9-5-3-6-10-20)27(40)26(39)17-34-38-31/h4,7-8,11-12,16,18-20,23-27,39-40H,3,5-6,9-10,13-15,17H2,1-2H3,(H,32,33)(H,35,43)(H,36,41)(H,37,42)

InChIKey

KYZQHPHXYFTWRL-UHFFFAOYSA-N

Smiles

CC(C)C(=O)NC(Cc1ccccc1)C(=O)NC(Cc2cnc[nH]2)C(=O)NC(CC3CCCCC3)C(C(CN=[N+]=[N-])O)O