2-azanyl-3-[1-[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]imidazol-4-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[1-[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]imidazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[1-[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]imidazol-4-yl]propanoic acid CAS Name: 2-amino-3-[1-[2-[[2-[(2-amino-3-hydroxy-1-oxobutyl)amino]-3-methyl-1-oxobutyl]amino]-4-methyl-1-oxopentyl]-4-imidazolyl]propanoic acid IUPAC Name: 2-amino-3-[1-[2-[[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]imidazol-4-yl]propanoic acid Traditional Name: 2-amino-3-[1-[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]imidazol-4-yl]propionic acid Formula: C21H36N6O6 MolecularWeight: 468.54714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1C=C(N=C1)CC(C(=O)O)N)NC(=O)C(C(C)C)NC(=O)C(C(C)O)N

Isomeric SMILES

CC(C)CC(C(=O)N1C=C(N=C1)CC(C(=O)O)N)NC(=O)C(C(C)C)NC(=O)C(C(C)O)N

InChI

InChI=1S/C21H36N6O6/c1-10(2)6-15(20(31)27-8-13(24-9-27)7-14(22)21(32)33)25-19(30)17(11(3)4)26-18(29)16(23)12(5)28/h8-12,14-17,28H,6-7,22-23H2,1-5H3,(H,25,30)(H,26,29)(H,32,33)