4-[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]propanoylamino]-5-oxidanylidene-5-[[1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]propan-2-yl]amino]pentanoic acid

Systemtic Name: 4-[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]propanoylamino]-5-oxidanylidene-5-[[1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]propan-2-yl]amino]pentanoic acid Openeye Name: 4-[2-[(2-amino-3-hydroxy-propanoyl)amino]propanoylamino]-5-[[2-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-1-methyl-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-[(2-amino-3-hydroxy-1-oxopropyl)amino]-1-oxopropyl]amino]-5-[[1-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-[2-[(2-amino-3-hydroxypropanoyl)amino]propanoylamino]-5-[[1-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-[2-[(2-amino-3-hydroxy-propanoyl)amino]propanoylamino]-5-[[2-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-2-keto-1-methyl-ethyl]amino]-5-keto-valeric acid Formula: C23H33N5O9 MolecularWeight: 523.53622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(C)NC(=O)C(CO)N

Isomeric SMILES

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(C)NC(=O)C(CO)N

InChI

InChI=1S/C23H33N5O9/c1-12(25-21(34)15(24)11-29)19(32)27-16(8-9-18(30)31)22(35)26-13(2)20(33)28-17(23(36)37)10-14-6-4-3-5-7-14/h3-7,12-13,15-17,29H,8-11,24H2,1-2H3,(H,25,34)(H,26,35)(H,27,32)(H,28,33)(H,30,31)(H,36,37)