tricopper; (2S)-2-azanyl-3-methyl-butanoate; (2R)-2-azanyl-3-sulfanyl-propanoate; (2S)-2,5-bis(azanyl)-5-oxidanylidene-pentanoate; (2S)-pyrrolidine-2-carboxylate

Systemtic Name: tricopper; (2S)-2-azanyl-3-methyl-butanoate; (2R)-2-azanyl-3-sulfanyl-propanoate; (2S)-2,5-bis(azanyl)-5-oxidanylidene-pentanoate; (2S)-pyrrolidine-2-carboxylate Openeye Name: tricopper; (2S)-2-amino-3-methyl-butanoate; (2R)-2-amino-3-sulfanyl-propanoate; (2S)-2,5-diamino-5-oxo-pentanoate; (2S)-pyrrolidine-2-carboxylate CAS Name: tricopper; (2R)-2-amino-3-mercaptopropanoate; (2S)-2-amino-3-methylbutanoate; (2S)-2,5-diamino-5-oxopentanoate; (2S)-2-pyrrolidinecarboxylate IUPAC Name: tricopper; (2S)-2-amino-3-methylbutanoate; (2R)-2-amino-3-sulfanylpropanoate; (2S)-2,5-diamino-5-oxopentanoate; (2S)-pyrrolidine-2-carboxylate Traditional Name: tricupric; (2R)-2-amino-3-mercapto-propionate; (2S)-2-amino-3-methyl-butyrate; (2S)-2,5-diamino-5-keto-valerate; (2S)-pyrrolidine-2-carboxylate Formula: C26H49Cu3N7O13S2 MolecularWeight: 922.47436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N.CC(C)C(C(=O)[O-])N.C1CC(NC1)C(=O)[O-].C(CC(=O)N)C(C(=O)[O-])N.C(C(C(=O)[O-])N)S.C(C(C(=O)[O-])N)S.[Cu+2].[Cu+2].[Cu+2]

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])N.CC(C)[C@@H](C(=O)[O-])N.C1C[C@H](NC1)C(=O)[O-].C(CC(=O)N)[C@@H](C(=O)[O-])N.C([C@@H](C(=O)[O-])N)S.C([C@@H](C(=O)[O-])N)S.[Cu+2].[Cu+2].[Cu+2]

InChI

InChI=1S/C5H10N2O3.C5H9NO2.2C5H11NO2.2C3H7NO2S.3Cu/c6-3(5(9)10)1-2-4(7)8;7-5(8)4-2-1-3-6-4;2*1-3(2)4(6)5(7)8;2*4-2(1-7)3(5)6;;;/h3H,1-2,6H2,(H2,7,8)(H,9,10);4,6H,1-3H2,(H,7,8);2*3-4H,6H2,1-2H3,(H,7,8);2*2,7H,1,4H2,(H,5,6);;;/q;;;;;;3*+2/p-6/t3-;3*4-;2*2-;;;/m000000.../s1