2-[[2-[[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-propanoyl]amino]-3-methyl-pentanoic acid

Systemtic Name: 2-[[2-[[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-propanoyl]amino]-3-methyl-pentanoic acid Openeye Name: 2-[[2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-5-hydroxy-5-oxo-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-5-hydroxy-1,5-dioxopentyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-hydroxy-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-[[2-[[2-[(2-amino-4-methylpentanoyl)amino]-5-hydroxy-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-5-hydroxy-5-keto-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-3-methyl-valeric acid Formula: C29H45N5O10 MolecularWeight: 623.6951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H45N5O10/c1-5-16(4)24(29(43)44)34-28(42)22(14-35)33-27(41)21(13-17-6-8-18(36)9-7-17)32-26(40)20(10-11-23(37)38)31-25(39)19(30)12-15(2)3/h6-9,15-16,19-22,24,35-36H,5,10-14,30H2,1-4H3,(H,31,39)(H,32,40)(H,33,41)(H,34,42)(H,37,38)(H,43,44)