2-oxidanylpropane-1,2,3-tricarboxylate; propane-1,2-diol

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylate; propane-1,2-diol Openeye Name: propane-1,2-diol citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; propane-1,2-diol IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; propane-1,2-diol Traditional Name: propane-1,2-diol citrate Formula: C9H13O9-3 MolecularWeight: 265.19412

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CC(CO)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C6H8O7.C3H8O2/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-3(5)2-4/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);3-5H,2H2,1H3/p-3