pentacopper; 2-azanylethanoate; (2S)-2-azanyl-3-methyl-butanoate; (2S)-2-azanyl-4-methyl-pentanoate; (2S)-2-azanylpropanoate; (2R)-2-azanyl-3-sulfanyl-propanoate

Systemtic Name: pentacopper; 2-azanylethanoate; (2S)-2-azanyl-3-methyl-butanoate; (2S)-2-azanyl-4-methyl-pentanoate; (2S)-2-azanylpropanoate; (2R)-2-azanyl-3-sulfanyl-propanoate Openeye Name: pentacopper; 2-aminoacetate; (2S)-2-amino-3-methyl-butanoate; (2S)-2-amino-4-methyl-pentanoate; (2S)-2-aminopropanoate; (2R)-2-amino-3-sulfanyl-propanoate CAS Name: pentacopper; 2-aminoacetate; (2R)-2-amino-3-mercaptopropanoate; (2S)-2-amino-3-methylbutanoate; (2S)-2-amino-4-methylpentanoate; (2S)-2-aminopropanoate IUPAC Name: pentacopper; 2-aminoacetate; (2S)-2-amino-3-methylbutanoate; (2S)-2-amino-4-methylpentanoate; (2S)-2-aminopropanoate; (2R)-2-amino-3-sulfanylpropanoate Traditional Name: pentacupric; 2-aminoacetate; (2R)-2-amino-3-mercapto-propionate; (2S)-2-amino-3-methyl-butyrate; (2S)-2-amino-4-methyl-valerate; (2S)-2-aminopropionate Formula: C31H62Cu5N10O20S2 MolecularWeight: 1276.73898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H13NO2.C5H11NO2.2C3H7NO2S.2C3H7NO2.4C2H5NO2.5Cu/c1-4(2)3-5(7)6(8)9;1-3(2)4(6)5(7)8;2*4-2(1-7)3(5)6;2*1-2(4)3(5)6;4*3-1-2(4)5;;;;;/h4-5H,3,7H2,1-2H3,(H,8,9);3-4H,6H2,1-2H3,(H,7,8);2*2,7H,1,4H2,(H,5,6);2*2H,4H2,1H3,(H,5,6);4*1,3H2,(H,4,5);;;;;/q;;;;;;;;;;5*+2/p-10/t5-;4-;4*2-;;;;;;;;;/m000000........./s1