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Substance Name: Poa-His-Cha-psi(CH(OH)CH(OH))-Val-Ile-Amp
RN: 134458-76-7
InChIKey: MULWYLFLHDMZRF-OVUDBSIZSA-N

Molecular Formula

  • C41-H59-N7-O7

Molecular Weight

  • 761.9591
 
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Names and Synonyms

Results Name

  • Poa-His-Cha-psi(CH(OH)CH(OH))-Val-Ile-Amp

Synonym

  • Poa-His-Cha-psi(CH(OH)CH(OH))-Val-Ile-Amp

Systematic Name

  • L-Idonamide, 2,5,6-trideoxy-5-((3-(1H-imidazol-4-yl)-2-(((1-naphthalenyloxy)acetyl)amino)-1-oxopropyl)amino)-N-(2-methyl-1-(((2-pyridinylmethyl)amino)carbonyl)butyl)-6-phenyl-2-(phenylmethyl)-, (1(1S,2S),5(S))-

Registry Numbers

CAS Registry Number

  • 134458-76-7

System Generated Number

  • 0134458767

Structure Descriptors

InChI

1S/C41H59N7O7/c1-5-27(4)36(41(54)44-23-29-16-12-13-19-43-29)48-40(53)35(26(2)3)38(51)37(50)32(20-28-14-8-6-9-15-28)47-39(52)33(21-30-22-42-25-45-30)46-34(49)24-55-31-17-10-7-11-18-31/h7,10-13,16-19,22,25-28,32-33,35-38,50-51H,5-6,8-9,14-15,20-21,23-24H2,1-4H3,(H,42,45)(H,44,54)(H,46,49)(H,47,52)(H,48,53)/t27-,32-,33-,35+,36-,37+,38+/m0/s1

InChIKey

MULWYLFLHDMZRF-OVUDBSIZSA-N

Smiles

CC[C@H](C)[C@@H](C(=O)NCc1ccccn1)NC(=O)[C@@H]([C@H]([C@@H]([C@H](CC2CCCCC2)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)COc4ccccc4)O)O)C(C)C