Kkkkllapflffv

Structural Information

Molecular Formula

C₈₂H₁₃₁N₁₇O₁₄

SMILES

C[C@@H](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](CC4=CC=CC=C4)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C82H131N17O14/c1-50(2)44-62(93-75(105)63(45-51(3)4)92-73(103)61(37-22-26-42-86)91-72(102)60(36-21-25-41-85)90-71(101)59(35-20-24-40-84)89-70(100)58(87)34-19-23-39-83)74(104)88-54(9)81(111)99-43-27-38-68(99)80(110)97-66(48-56-30-15-11-16-31-56)78(108)94-64(46-52(5)6)76(106)95-65(47-55-28-13-10-14-29-55)77(107)96-67(49-57-32-17-12-18-33-57)79(109)98-69(53(7)8)82(112)113/h10-18,28-33,50-54,58-69H,19-27,34-49,83-87H2,1-9H3,(H,88,104)(H,89,100)(H,90,101)(H,91,102)(H,92,103)(H,93,105)(H,94,108)(H,95,106)(H,96,107)(H,97,110)(H,98,109)(H,112,113)/t54-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-/m0/s1

InChIKey

QCMZWJGITZMNAD-KVAWFTNISA-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)-2,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoic acid

Related CIDs

• CID 16073132