Lkkklllpflflf

Structural Information

Molecular Formula

C₈₆H₁₃₈N₁₆O₁₄

SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)O)N

InChI

InChI=1S/C86H138N16O14/c1-52(2)43-61(90)74(103)91-62(35-22-25-39-87)75(104)92-63(36-23-26-40-88)76(105)93-64(37-24-27-41-89)77(106)94-65(44-53(3)4)78(107)95-67(46-55(7)8)80(109)100-71(48-57(11)12)85(114)102-42-28-38-73(102)84(113)99-70(50-59-31-18-14-19-32-59)83(112)96-66(45-54(5)6)79(108)98-69(49-58-29-16-13-17-30-58)82(111)97-68(47-56(9)10)81(110)101-72(86(115)116)51-60-33-20-15-21-34-60/h13-21,29-34,52-57,61-73H,22-28,35-51,87-90H2,1-12H3,(H,91,103)(H,92,104)(H,93,105)(H,94,106)(H,95,107)(H,96,112)(H,97,111)(H,98,108)(H,99,113)(H,100,109)(H,101,110)(H,115,116)/t61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-/m0/s1

InChIKey

NDDTVWIHSQOCGY-MBGNAQBDSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-amino-4-methylpentanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid

Related CIDs

• CID 16073100