(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[2-[[(2R)-4-[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-acetamido-3-carboxy-propanoyl]amino]propanoyl]amino]-2-methyl-propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidin-2-yl]-2-methyl-butanoyl]amino]acetyl]amino]-2-methyl-propanoyl]amino]propanoyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]-methyl-amino]-3-methyl-butanoic acid

Molecular Formula: C53H88N12O16


InChI: InChI=1/C53H88N12O16/c1-26(2)39(48(77)65-23-17-19-36(65)47(76)63(15)40(27(3)4)49(78)79)60-43(72)30(7)58-50(80)52(11,12)61-37(67)25-54-41(70)28(5)20-21-34-18-16-22-64(34)46(75)32(9)56-42(71)29(6)57-51(81)53(13,14)62-44(73)31(8)55-45(74)35(24-38(68)69)59-33(10)66/h26-32,34-36,39-40H,16-25H2,1-15H3,(H,54,70)(H,55,74)(H,56,71)(H,57,81)(H,58,80)(H,59,66)(H,60,72)(H,61,67)(H,62,73)(H,68,69)(H,78,79)/t28-,29+,30+,31+,32+,34+,35+,36+,39+,40+/m1/s1/f/h54-62,68,78H

InChIKey: InChIKey=KSMHGPCUKSSOAJ-BUGSILJXDZ
SMILES: CC(C)C(C(=O)N1CCCC1C(=O)N(C)C(C(C)C)C(=O)O)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)CNC(=O)C(C)CCC2CCCN2C(=O)C(C)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(CC(=O)O)NC(=O)C

Names:
    (2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[2-[[(2R)-4-[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-acetamido-3-carboxy-propanoyl]amino]propanoyl]amino]-2-methyl-propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidin-2-yl]-2-methyl-butanoyl]amino]acetyl]amino]-2-methyl-propanoyl]amino]propanoyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]-methyl-amino]-3-methyl-butanoic acid

Registries:
    PubChem CID 9941664
    PubChem ID 14914868