calcium (2S,3R)-3-carboxyoxirane-2-carboxylate

Systemtic Name: calcium (2S,3R)-3-carboxyoxirane-2-carboxylate Openeye Name: calcium (2S,3R)-3-carboxyoxirane-2-carboxylate CAS Name: calcium (2S,3R)-3-carboxy-2-oxiranecarboxylate IUPAC Name: calcium (2S,3R)-3-carboxyoxirane-2-carboxylate Traditional Name: calcium (2S,3R)-3-carboxyoxirane-2-carboxylate Formula: C8H6CaO10 MolecularWeight: 302.20524

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Descriptors Computed from Structure

Canonical SMILES:

C1(C(O1)C(=O)[O-])C(=O)O.C1(C(O1)C(=O)[O-])C(=O)O.[Ca+2]

Isomeric SMILES

[C@@H]1([C@H](O1)C(=O)[O-])C(=O)O.[C@@H]1([C@H](O1)C(=O)[O-])C(=O)O.[Ca+2]

InChI

InChI=1S/2C4H4O5.Ca/c2*5-3(6)1-2(9-1)4(7)8;/h2*1-2H,(H,5,6)(H,7,8);/q;;+2/p-2/t2*1-,2+;