Kkkklvlpfyfff

Structural Information

Molecular Formula

C₉₁H₁₃₃N₁₇O₁₅

SMILES

CC(C)C[C@@H](C(=O)N[C@@H](C(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](CC3=CC=C(C=C3)O)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CC6=CC=CC=C6)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/C91H133N17O15/c1-57(2)50-70(100-82(113)69(39-22-26-48-95)99-81(112)68(38-21-25-47-94)98-80(111)67(37-20-24-46-93)97-79(110)66(96)36-19-23-45-92)87(118)107-78(59(5)6)89(120)105-75(51-58(3)4)90(121)108-49-27-40-77(108)88(119)104-74(54-62-32-15-9-16-33-62)85(116)103-73(55-64-41-43-65(109)44-42-64)84(115)101-71(52-60-28-11-7-12-29-60)83(114)102-72(53-61-30-13-8-14-31-61)86(117)106-76(91(122)123)56-63-34-17-10-18-35-63/h7-18,28-35,41-44,57-59,66-78,109H,19-27,36-40,45-56,92-96H2,1-6H3,(H,97,110)(H,98,111)(H,99,112)(H,100,113)(H,101,115)(H,102,114)(H,103,116)(H,104,119)(H,105,120)(H,106,117)(H,107,118)(H,122,123)/t66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-/m0/s1

InChIKey

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

Related CIDs

• CID 16186491