Kkkklllpylfff

Structural Information

Molecular Formula

C₈₉H₁₃₇N₁₇O₁₅

SMILES

CC(C)C[C@@H](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=C(C=C2)O)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](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C89H137N17O15/c1-55(2)47-68(98-80(111)67(36-21-25-45-93)97-79(110)66(35-20-24-44-92)96-78(109)65(34-19-23-43-91)95-77(108)64(94)33-18-22-42-90)81(112)99-70(49-57(5)6)83(114)104-74(50-58(7)8)88(119)106-46-26-37-76(106)87(118)103-73(53-62-38-40-63(107)41-39-62)85(116)100-69(48-56(3)4)82(113)101-71(51-59-27-12-9-13-28-59)84(115)102-72(52-60-29-14-10-15-30-60)86(117)105-75(89(120)121)54-61-31-16-11-17-32-61/h9-17,27-32,38-41,55-58,64-76,107H,18-26,33-37,42-54,90-94H2,1-8H3,(H,95,108)(H,96,109)(H,97,110)(H,98,111)(H,99,112)(H,100,116)(H,101,113)(H,102,115)(H,103,118)(H,104,114)(H,105,117)(H,120,121)/t64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-/m0/s1

InChIKey

ZIBMWLKBWBSFSM-ACAZJKCISA-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]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acid

Related CIDs

• CID 16186480