(2S)-2-[[(2S)-2-[[(2S)-5-azanyl-5-oxidanylidene-2-[[(2S)-2-[[(2S,3R)-3-oxidanyl-2-[[(2S,3R)-3-oxidanyl-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]butanoyl]amino]butanoyl]amino]propanoyl]amino]pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-[[(2S)-5-azanyl-5-oxidanylidene-2-[[(2S)-2-[[(2S,3R)-3-oxidanyl-2-[[(2S,3R)-3-oxidanyl-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]butanoyl]amino]butanoyl]amino]propanoyl]amino]pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoic acid Openeye Name: (2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoyl]amino]butanoyl]amino]propanoyl]amino]-5-oxo-pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2S,3R)-3-hydroxy-1-oxo-2-[[oxo-[(2S)-2-pyrrolidinyl]methyl]amino]butyl]amino]-1-oxobutyl]amino]-1-oxopropyl]amino]-1,5-dioxopentyl]amino]-4-methyl-1-oxopentyl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoyl]amino]butanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]propanoic acid Traditional Name: (2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-prolyl]amino]butanoyl]amino]butanoyl]amino]propanoyl]amino]-5-keto-pentanoyl]amino]-4-methyl-pentanoyl]amino]propionic acid Formula: C30H52N8O11 MolecularWeight: 700.78088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)O)NC(=O)C(CCC(=O)N)NC(=O)C(C)NC(=O)C(C(C)O)NC(=O)C(C(C)O)NC(=O)C1CCCN1

Isomeric SMILES

C[C@H]([C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@@H]1CCCN1)O

InChI

InChI=1S/C30H52N8O11/c1-13(2)12-20(27(45)34-15(4)30(48)49)36-26(44)19(9-10-21(31)41)35-24(42)14(3)33-28(46)22(16(5)39)38-29(47)23(17(6)40)37-25(43)18-8-7-11-32-18/h13-20,22-23,32,39-40H,7-12H2,1-6H3,(H2,31,41)(H,33,46)(H,34,45)(H,35,42)(H,36,44)(H,37,43)(H,38,47)(H,48,49)/t14-,15-,16+,17+,18-,19-,20-,22-,23-/m0/s1