N-(PYRAZIN-2-YLCARBONYL)LEUCYLISOLEUCYL-N¹-{1-[2-({1-CARBOXY-2-[4-(PHOSPHONOOXY)PHENYL]ETHYL}AMINO)-1,1-DIHYDROXY-2-OXOETHYL]BUT-3-ENYL}-3-CYCLOHEXYLALANINAMIDE

More details:

• Systematic name

  N-(2-Pyrazinylcarbonyl)-L-leucyl-L-isoleucyl-N-[(3S)-1-({(1S)-1-carboxy-2-[4-(phosphonooxy)phenyl]ethyl}amino)-2,2-dihydroxy-1-oxo-5-hexen-3-yl]-3-cyclohexyl-L-alaninamide

• SMILES

  CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC=C)C(C(=O)N[C@@H](Cc2ccc(cc2)OP(=O)(O)O)C(=O)O)(O)O)NC(=O)[C@H](CC(C)C)NC(=O)c3cnccn3

• Std. InChi

  InChI=1S/C41H60N7O13P/c1-6-11-33(41(56,57)40(55)46-31(39(53)54)22-27-14-16-28(17-15-27)61-62(58,59)60)47-35(49)30(21-26-12-9-8-10-13-26)45-38(52)34(25(5)7-2)48-36(50)29(20-24(3)4)44-37(51)32-23-42-18-19-43-32/h6,14-19,23-26,29-31,33-34,56-57H,1,7-13,20-22H2,2-5H3,(H,44,51)(H,45,52)(H,46,55)(H,47,49)(H,48,50)(H,53,54)(H2,58,59,60)/t25-,29-,30-,31-,33-,34-/m0/s1

• Std. InChIKey

  NANINTGNSYDVAR-PBWGIQFFSA-N

• Cite this record

  CSID:395175, http://www.chemspider.com/Chemical-Structure.395175.html (accessed 21:19, Apr 23, 2024)