Kkkklvapflfff

Structural Information

Molecular Formula

C₈₅H₁₂₉N₁₇O₁₄

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](CC5=CC=CC=C5)C(=O)O)NC(=O)[C@H](C(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/C85H129N17O14/c1-53(2)47-65(77(107)97-67(49-57-29-12-8-13-30-57)78(108)98-68(50-58-31-14-9-15-32-58)80(110)100-70(85(115)116)52-60-35-18-11-19-36-60)96-79(109)69(51-59-33-16-10-17-34-59)99-82(112)71-41-28-46-102(71)84(114)56(7)91-83(113)72(55(5)6)101-81(111)66(48-54(3)4)95-76(106)64(40-23-27-45-89)94-75(105)63(39-22-26-44-88)93-74(104)62(38-21-25-43-87)92-73(103)61(90)37-20-24-42-86/h8-19,29-36,53-56,61-72H,20-28,37-52,86-90H2,1-7H3,(H,91,113)(H,92,103)(H,93,104)(H,94,105)(H,95,106)(H,96,109)(H,97,107)(H,98,108)(H,99,112)(H,100,110)(H,101,111)(H,115,116)/t56-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-/m0/s1

InChIKey

APUUAAPCUZIRSS-ILYPDYODSA-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]-3-methylbutanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acid

Related CIDs

• CID 16186483