aluminum (2S)-2-acetamido-5-azanyl-5-oxidanylidene-pentanoate

Systemtic Name: aluminum (2S)-2-acetamido-5-azanyl-5-oxidanylidene-pentanoate Openeye Name: aluminum (2S)-2-acetamido-5-amino-5-oxo-pentanoate CAS Name: aluminum (2S)-2-acetamido-5-amino-5-oxopentanoate IUPAC Name: aluminum (2S)-2-acetamido-5-amino-5-oxopentanoate Traditional Name: aluminum (2S)-2-acetamido-5-amino-5-keto-valerate Formula: C21H33AlN6O12 MolecularWeight: 588.501258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)N)C(=O)[O-].CC(=O)NC(CCC(=O)N)C(=O)[O-].CC(=O)NC(CCC(=O)N)C(=O)[O-].[Al+3]

Isomeric SMILES

CC(=O)N[C@@H](CCC(=O)N)C(=O)[O-].CC(=O)N[C@@H](CCC(=O)N)C(=O)[O-].CC(=O)N[C@@H](CCC(=O)N)C(=O)[O-].[Al+3]

InChI

InChI=1S/3C7H12N2O4.Al/c3*1-4(10)9-5(7(12)13)2-3-6(8)11;/h3*5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13);/q;;;+3/p-3/t3*5-;/m000./s1