Nh2-leu-phe-phe-leu-leu-thr-val-pro-phe-trp-ala-his-tyr-ala-cooh

Structural Information

Molecular Formula

C₉₁H₁₂₁N₁₇O₁₇

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@@H](C)C(=O)N[C@@H](CC5=CN=CN5)C(=O)N[C@@H](CC6=CC=C(C=C6)O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC7=CC=CC=C7)NC(=O)[C@H](CC8=CC=CC=C8)NC(=O)[C@H](CC(C)C)N)O

InChI

InChI=1S/C91H121N17O17/c1-50(2)38-65(92)79(112)99-70(41-57-24-15-12-16-25-57)83(116)103-71(42-58-26-17-13-18-27-58)84(117)100-67(39-51(3)4)82(115)101-68(40-52(5)6)87(120)107-77(56(11)109)89(122)106-76(53(7)8)90(123)108-37-23-32-75(108)88(121)105-72(43-59-28-19-14-20-29-59)85(118)104-73(45-61-47-94-66-31-22-21-30-64(61)66)81(114)96-54(9)78(111)98-74(46-62-48-93-49-95-62)86(119)102-69(80(113)97-55(10)91(124)125)44-60-33-35-63(110)36-34-60/h12-22,24-31,33-36,47-56,65,67-77,94,109-110H,23,32,37-46,92H2,1-11H3,(H,93,95)(H,96,114)(H,97,113)(H,98,111)(H,99,112)(H,100,117)(H,101,115)(H,102,119)(H,103,116)(H,104,118)(H,105,121)(H,106,122)(H,107,120)(H,124,125)/t54-,55-,56+,65-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-/m0/s1

InChIKey

BAHTZMDWOGNGNA-ICBQGZGMSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]propanoic acid

Related CIDs

• CID 16728440