3-[1-[[(2S,3S)-2,3-diacetyloxy-4-[[1-(2-carboxyethyloxy)-2-methyl-butyl]amino]-4-oxidanylidene-butanoyl]amino]-2-methyl-butoxy]propanoic acid

Systemtic Name: 3-[1-[[(2S,3S)-2,3-diacetyloxy-4-[[1-(2-carboxyethyloxy)-2-methyl-butyl]amino]-4-oxidanylidene-butanoyl]amino]-2-methyl-butoxy]propanoic acid Openeye Name: 3-[1-[[(2S,3S)-2,3-diacetoxy-4-[[1-(2-carboxyethyloxy)-2-methyl-butyl]amino]-4-oxo-butanoyl]amino]-2-methyl-butoxy]propanoic acid CAS Name: 3-[1-[[(2S,3S)-2,3-diacetyloxy-4-[[1-(2-carboxyethyloxy)-2-methylbutyl]amino]-1,4-dioxobutyl]amino]-2-methylbutoxy]propanoic acid IUPAC Name: 3-[1-[[(2S,3S)-2,3-diacetyloxy-4-[[1-(2-carboxyethyloxy)-2-methylbutyl]amino]-4-oxobutanoyl]amino]-2-methylbutoxy]propanoic acid Traditional Name: 3-[1-[[(2S,3S)-2,3-diacetoxy-4-[[1-(2-carboxyethyloxy)-2-methyl-butyl]amino]-4-keto-butanoyl]amino]-2-methyl-butoxy]propionic acid Formula: C24H40N2O12 MolecularWeight: 548.5806

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(NC(=O)C(C(C(=O)NC(C(C)CC)OCCC(=O)O)OC(=O)C)OC(=O)C)OCCC(=O)O

Isomeric SMILES

CCC(C)C(NC(=O)[C@H]([C@@H](C(=O)NC(C(C)CC)OCCC(=O)O)OC(=O)C)OC(=O)C)OCCC(=O)O

InChI

InChI=1S/C24H40N2O12/c1-7-13(3)23(35-11-9-17(29)30)25-21(33)19(37-15(5)27)20(38-16(6)28)22(34)26-24(14(4)8-2)36-12-10-18(31)32/h13-14,19-20,23-24H,7-12H2,1-6H3,(H,25,33)(H,26,34)(H,29,30)(H,31,32)/t13?,14?,19-,20-,23?,24?/m0/s1