(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 3-methyl-3-oxidanyl-butanoate

Systemtic Name: (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 3-methyl-3-oxidanyl-butanoate Openeye Name: (2S)-2-amino-5-guanidino-pentanoic acid; 3-hydroxy-3-methyl-butanoate CAS Name: (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid; 3-hydroxy-3-methylbutanoate IUPAC Name: (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid; 3-hydroxy-3-methylbutanoate Traditional Name: (2S)-2-amino-5-guanidino-valeric acid; 3-hydroxy-3-methyl-butyrate Formula: C11H23N4O5- MolecularWeight: 291.32412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)[O-])O.C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

CC(C)(CC(=O)[O-])O.C(C[C@@H](C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C6H14N4O2.C5H10O3/c7-4(5(11)12)2-1-3-10-6(8)9;1-5(2,8)3-4(6)7/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);8H,3H2,1-2H3,(H,6,7)/p-1/t4-;/m0./s1