2-oxidanylbutanedioic acid hydrate

Systemtic Name: 2-oxidanylbutanedioic acid hydrate Openeye Name: 2-hydroxybutanedioic acid hydrate CAS Name: 2-hydroxybutanedioic acid hydrate IUPAC Name: 2-hydroxybutanedioic acid hydrate Traditional Name: malic acid hydrate Formula: C4H8O6 MolecularWeight: 152.10272

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)O)O)C(=O)O.O

Isomeric SMILES

C(C(C(=O)O)O)C(=O)O.O

InChI

InChI=1S/C4H6O5.H2O/c5-2(4(8)9)1-3(6)7;/h2,5H,1H2,(H,6,7)(H,8,9);1H2