2-[2-[[2-[[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]propanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[[2-[[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]propanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]propanoylamino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-1-oxobutyl)amino]-4-methyl-1-oxopentyl]amino]-4-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxopropyl]amino]-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[2-[[2-[[2-[[2-[(2-amino-3-hydroxybutanoyl)amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]propanoylamino]-4-methylpentanoic acid Traditional Name: 2-[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]propanoylamino]-4-methyl-valeric acid Formula: C28H52N6O9 MolecularWeight: 616.74728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H52N6O9/c1-13(2)9-18(31-24(38)19(10-14(3)4)32-27(41)22(29)17(8)36)25(39)34-21(12-35)26(40)30-16(7)23(37)33-20(28(42)43)11-15(5)6/h13-22,35-36H,9-12,29H2,1-8H3,(H,30,40)(H,31,38)(H,32,41)(H,33,37)(H,34,39)(H,42,43)