calcium (2S)-2-[(1S)-1,2-bis(oxidanyl)ethyl]-4-oxidanyl-5-oxidanylidene-oxolan-3-olate

Systemtic Name: calcium (2S)-2-[(1S)-1,2-bis(oxidanyl)ethyl]-4-oxidanyl-5-oxidanylidene-oxolan-3-olate Openeye Name: calcium (2S)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-tetrahydrofuran-3-olate CAS Name: calcium (2S)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-3-oxolanolate IUPAC Name: calcium (2S)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-oxooxolan-3-olate Traditional Name: calcium (2S)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-keto-tetrahydrofuran-3-olate Formula: C12H18CaO12 MolecularWeight: 394.34212

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C1C(C(C(=O)O1)O)[O-])O)O.C(C(C1C(C(C(=O)O1)O)[O-])O)O.[Ca+2]

Isomeric SMILES

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

InChI

InChI=1S/2C6H9O6.Ca/c2*7-1-2(8)5-3(9)4(10)6(11)12-5;/h2*2-5,7-8,10H,1H2;/q2*-1;+2/t2*2-,3?,4?,5+;/m00./s1