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Substance Name: CGP 75176
RN: 198904-13-1
InChIKey: BFKMYBHUMHOWJH-YVHASNINSA-N

Molecular Formula

  • C35-H51-N9-O7

Molecular Weight

  • 709.8439
 
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Names and Synonyms

Results Name

  • CGP 75176

Synonyms

  • 1-(4-(2-Methyl-2H-tetrazol-5-yl)-phenyl)-4(S)-hydroxy-5(S)-2,5-bis(N-(N-methoxycarbonyl-(L)-tert-leucyl)amino)-6-phenyl-2-azahexane
  • CGP 75176

Systematic Name

  • 2,5,6,10,13-Pentaazatetradecanedioic acid, 3,12-bis(1,1-dimethylethyl)-8-hydroxy-6-((4-(2-methyl-2H-tetrazol-5-yl)phenyl)methyl)-4,11-dioxo-9-(phenylmethyl)-, dimethyl ester, (3S,8S,9S,12S)-

Registry Numbers

CAS Registry Number

  • 198904-13-1

System Generated Number

  • 0198904131

Structure Descriptors

InChI

1S/C35H51N9O7/c1-34(2,3)27(37-32(48)50-8)30(46)36-25(19-22-13-11-10-12-14-22)26(45)21-44(41-31(47)28(35(4,5)6)38-33(49)51-9)20-23-15-17-24(18-16-23)29-39-42-43(7)40-29/h10-18,25-28,45H,19-21H2,1-9H3,(H,36,46)(H,37,48)(H,38,49)(H,41,47)/t25-,26-,27+,28+/m0/s1

InChIKey

BFKMYBHUMHOWJH-YVHASNINSA-N

Smiles

CC(C)(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)[C@H](CN(Cc2ccc(cc2)c3nnn(n3)C)NC(=O)[C@H](C(C)(C)C)NC(=O)OC)O)NC(=O)OC