Tyiffvfdqkeedd

Structural Information

Molecular Formula

C₈₄H₁₁₄N₁₆O₂₈

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H]([C@@H](C)O)N

InChI

InChI=1S/C84H114N16O28/c1-6-44(4)70(100-80(123)58(95-81(124)68(87)45(5)101)39-49-25-27-50(102)28-26-49)83(126)97-56(37-47-20-12-8-13-21-47)75(118)92-57(38-48-22-14-9-15-23-48)79(122)99-69(43(2)3)82(125)96-55(36-46-18-10-7-11-19-46)76(119)94-59(40-65(108)109)77(120)91-52(29-32-62(86)103)72(115)88-51(24-16-17-35-85)71(114)89-53(30-33-63(104)105)73(116)90-54(31-34-64(106)107)74(117)93-60(41-66(110)111)78(121)98-61(84(127)128)42-67(112)113/h7-15,18-23,25-28,43-45,51-61,68-70,101-102H,6,16-17,24,29-42,85,87H2,1-5H3,(H2,86,103)(H,88,115)(H,89,114)(H,90,116)(H,91,120)(H,92,118)(H,93,117)(H,94,119)(H,95,124)(H,96,125)(H,97,126)(H,98,121)(H,99,122)(H,100,123)(H,104,105)(H,106,107)(H,108,109)(H,110,111)(H,112,113)(H,127,128)/t44-,45+,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,68-,69-,70-/m0/s1

InChIKey

DNLJEGMRJUNSAJ-FYUVFJDBSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-3-carboxypropanoyl]amino]-5-oxopentanoyl]amino]hexanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-carboxypropanoyl]amino]butanedioic acid

Related CIDs

• CID 16130264