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Substance Name: 1H-Imidazole-4-propanamide, N-(2,3-dihydroxy-5-methyl-1-(2-methylpropyl)-4-(((2-methyl-1-(((2-pyridinylmethyl)amino)carbonyl)butyl)amino)carbonyl)hexyl)-alpha-((phenoxyacetyl)amino)-, (1S-(1R*(R*),2S*,3S*,4S*(1R*,2R*)))-
RN: 112190-16-6
InChIKey: IDJURXHCQDOVHQ-TZNNLCDBSA-N

Molecular Formula

  • C38-H55-N7-O7

Molecular Weight

  • 721.8945
 
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Names and Synonyms

  • 1H-Imidazole-4-propanamide, N-(2,3-dihydroxy-5-methyl-1-(2-methylpropyl)-4-(((2-methyl-1-(((2-pyridinylmethyl)amino)carbonyl)butyl)amino)carbonyl)hexyl)-alpha-((phenoxyacetyl)amino)-, (1S-(1R*(R*),2S*,3S*,4S*(1R*,2R*)))-

Registry Numbers

CAS Registry Number

  • 112190-16-6

System Generated Number

  • 0112190166

Structure Descriptors

InChI

1S/C38H55N7O7/c1-7-25(6)33(38(51)41-20-26-13-11-12-16-40-26)45-37(50)32(24(4)5)35(48)34(47)29(17-23(2)3)44-36(49)30(18-27-19-39-22-42-27)43-31(46)21-52-28-14-9-8-10-15-28/h8-16,19,22-25,29-30,32-35,47-48H,7,17-18,20-21H2,1-6H3,(H,39,42)(H,41,51)(H,43,46)(H,44,49)(H,45,50)/t25-,29-,30-,32+,33-,34+,35+/m0/s1

InChIKey

IDJURXHCQDOVHQ-TZNNLCDBSA-N

Smiles

CC[C@H](C)[C@@H](C(=O)NCc1ccccn1)NC(=O)[C@@H]([C@H]([C@@H]([C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)COc3ccccc3)O)O)C(C)C