1-[2-[[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-[(2-amino-3-hydroxy-propanoyl)amino]-4-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-[(2-amino-3-hydroxy-1-oxopropyl)amino]-4-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-[(2-amino-3-hydroxypropanoyl)amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-[(2-amino-3-hydroxy-propanoyl)amino]-4-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]proline Formula: C18H32N4O7 MolecularWeight: 416.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C(C)O)C(=O)N1CCCC1C(=O)O)NC(=O)C(CO)N

Isomeric SMILES

CC(C)CC(C(=O)NC(C(C)O)C(=O)N1CCCC1C(=O)O)NC(=O)C(CO)N

InChI

InChI=1S/C18H32N4O7/c1-9(2)7-12(20-15(25)11(19)8-23)16(26)21-14(10(3)24)17(27)22-6-4-5-13(22)18(28)29/h9-14,23-24H,4-8,19H2,1-3H3,(H,20,25)(H,21,26)(H,28,29)