N-{[1-(N-{[(2S)-1-Acetyl-2-piperidinyl]carbonyl}-2-methylalanyl)-2-piperidinyl]carbonyl}isovalylisovalyl-L-leucyl-β-alanyl-N-[1-({1-[(2S)-2-({1-[(carboxymethyl)amino]-2-methyl-1-oxo-2-propanyl}carb amoyl)-1-piperidinyl]-2-methyl-1-oxo-2-propanyl}carbamoyl)cyclopropyl]glycinamide

More details:

• Systematic name

  N-{[1-(N-{[(2S)-1-Acetyl-2-piperidinyl]carbonyl}-2-methylalanyl)-2-piperidinyl]carbonyl}isovalylisovalyl-L-leucyl-beta-alanyl-N-[1-({1-[(2S)-2-({1-[(carboxymethyl)amino]-2-methyl-1-oxo-2-propanyl}carb amoyl)-1-piperidinyl]-2-methyl-1-oxo-2-propanyl}carbamoyl)cyclopropyl]glycinamide

• SMILES

  CC(=O)N1CCCC[C@H]1C(=O)NC(C)(C)C(=O)N1CCCCC1C(=O)NC(C)(CC)C(=O)NC(C)(CC)C(=O)N[C@@H](CC(C)C)C(=O)NCCC(=O)NCC(=O)NC1(CC1)C(=O)NC(C)(C)C(=O)N1CCCC[C@H]1C(=O)NC(C)(C)C(=O)NCC(O)=O

• Std. InChi

  InChI=1S/C59H97N13O15/c1-14-57(12,69-50(84)58(13,15-2)67-47(81)40-24-18-21-31-72(40)52(86)55(8,9)66-45(79)38-22-16-19-29-70(38)36(5)73)49(83)63-37(32-35(3)4)44(78)60-28-25-41(74)61-33-42(75)64-59(26-27-59)51(85)68-56(10,11)53(87)71-30-20-17-23-39(71)46(80)65-54(6,7)48(82)62-34-43(76)77/h35,37-40H,14-34H2,1-13H3,(H,60,78)(H,61,74)(H,62,82)(H,63,83)(H,64,75)(H,65,80)(H,66,79)(H,67,81)(H,68,85)(H,69,84)(H,76,77)/t37-,38-,39-,40?,57?,58?/m0/s1

• Std. InChIKey

  HEESDQJBDWZEDS-VGTOESSISA-N

• Cite this record

  CSID:78445188, http://www.chemspider.com/Chemical-Structure.78445188.html (accessed 17:38, Jun 2, 2024)