Tyiffvffqkeedd

Structural Information

Molecular Formula

C₈₉H₁₁₈N₁₆O₂₆

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](CC4=CC=CC=C4)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](CC5=CC=C(C=C5)O)NC(=O)[C@H]([C@@H](C)O)N

InChI

InChI=1S/C89H118N16O26/c1-6-49(4)75(105-85(126)65(100-86(127)73(92)50(5)106)45-55-30-32-56(107)33-31-55)88(129)102-63(43-53-25-15-9-16-26-53)82(123)98-64(44-54-27-17-10-18-28-54)84(125)104-74(48(2)3)87(128)101-62(42-52-23-13-8-14-24-52)81(122)97-61(41-51-21-11-7-12-22-51)80(121)96-58(34-37-68(91)108)77(118)93-57(29-19-20-40-90)76(117)94-59(35-38-69(109)110)78(119)95-60(36-39-70(111)112)79(120)99-66(46-71(113)114)83(124)103-67(89(130)131)47-72(115)116/h7-18,21-28,30-33,48-50,57-67,73-75,106-107H,6,19-20,29,34-47,90,92H2,1-5H3,(H2,91,108)(H,93,118)(H,94,117)(H,95,119)(H,96,121)(H,97,122)(H,98,123)(H,99,120)(H,100,127)(H,101,128)(H,102,129)(H,103,124)(H,104,125)(H,105,126)(H,109,110)(H,111,112)(H,113,114)(H,115,116)(H,130,131)/t49-,50+,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,73-,74-,75-/m0/s1

InChIKey

RNKKSFXUCKZZRO-HNXJRZOOSA-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-phenylpropanoyl]amino]-5-oxopentanoyl]amino]hexanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-carboxypropanoyl]amino]butanedioic acid

Related CIDs

• CID 16130272