6-azanyl-2-[[1-[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-4-methyl-pentanoyl]pyrrolidin-2-yl]carbonylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[1-[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-4-methyl-pentanoyl]pyrrolidin-2-yl]carbonylamino]hexanoic acid Openeye Name: 6-amino-2-[[1-[2-[(2-amino-3-hydroxy-propanoyl)amino]-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid CAS Name: 6-amino-2-[[[1-[2-[(2-amino-3-hydroxy-1-oxopropyl)amino]-4-methyl-1-oxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[1-[2-[(2-amino-3-hydroxypropanoyl)amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[1-[2-[(2-amino-3-hydroxy-propanoyl)amino]-4-methyl-pentanoyl]prolyl]amino]hexanoic acid Formula: C20H37N5O6 MolecularWeight: 443.53768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H37N5O6/c1-12(2)10-15(24-17(27)13(22)11-26)19(29)25-9-5-7-16(25)18(28)23-14(20(30)31)6-3-4-8-21/h12-16,26H,3-11,21-22H2,1-2H3,(H,23,28)(H,24,27)(H,30,31)