2-azanyl-3-phosphonooxy-butanoic acid hydrate

Systemtic Name: 2-azanyl-3-phosphonooxy-butanoic acid hydrate Openeye Name: 2-amino-3-phosphonooxy-butanoic acid hydrate CAS Name: 2-amino-3-phosphonooxybutanoic acid hydrate IUPAC Name: 2-amino-3-phosphonooxybutanoic acid hydrate Traditional Name: 2-amino-3-phosphonooxy-butyric acid hydrate Formula: C4H12NO7P MolecularWeight: 217.114341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)N)OP(=O)(O)O.O

Isomeric SMILES

CC(C(C(=O)O)N)OP(=O)(O)O.O

InChI

InChI=1S/C4H10NO6P.H2O/c1-2(3(5)4(6)7)11-12(8,9)10;/h2-3H,5H2,1H3,(H,6,7)(H2,8,9,10);1H2