2-azanylpropanoyl 2-(2-acetamido-4-methyl-pentanoyl)-1-azanyl-2-[2,6-bis(azanyl)hexanoyl]-3-methyl-cyclopentane-1-carboxylate

Systemtic Name: 2-azanylpropanoyl 2-(2-acetamido-4-methyl-pentanoyl)-1-azanyl-2-[2,6-bis(azanyl)hexanoyl]-3-methyl-cyclopentane-1-carboxylate Openeye Name: 2-aminopropanoyl 2-(2-acetamido-4-methyl-pentanoyl)-1-amino-2-(2,6-diaminohexanoyl)-3-methyl-cyclopentanecarboxylate CAS Name: 2-(2-acetamido-4-methyl-1-oxopentyl)-1-amino-2-(2,6-diamino-1-oxohexyl)-3-methyl-1-cyclopentanecarboxylic acid (2-amino-1-oxopropyl) ester IUPAC Name: 2-aminopropanoyl 2-(2-acetamido-4-methylpentanoyl)-1-amino-2-(2,6-diaminohexanoyl)-3-methylcyclopentane-1-carboxylate Traditional Name: 2-(2-acetamido-4-methyl-pentanoyl)-1-amino-2-(2,6-diaminohexanoyl)-3-methyl-cyclopentanecarboxylic acid alanyl ester Formula: C24H43N5O6 MolecularWeight: 497.62812

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C1(C(=O)C(CCCCN)N)C(=O)C(CC(C)C)NC(=O)C)(C(=O)OC(=O)C(C)N)N

Isomeric SMILES

CC1CCC(C1(C(=O)C(CCCCN)N)C(=O)C(CC(C)C)NC(=O)C)(C(=O)OC(=O)C(C)N)N

InChI

InChI=1S/C24H43N5O6/c1-13(2)12-18(29-16(5)30)20(32)24(19(31)17(27)8-6-7-11-25)14(3)9-10-23(24,28)22(34)35-21(33)15(4)26/h13-15,17-18H,6-12,25-28H2,1-5H3,(H,29,30)