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calcium 2-acetyloxypropane-1,2,3-tricarboxylic acid

calcium 2-acetyloxypropane-1,2,3-tricarboxylic acid

Systemtic Name:calcium 2-acetyloxypropane-1,2,3-tricarboxylic acid
Openeye Name:calcium 2-acetoxypropane-1,2,3-tricarboxylic acid
CAS Name:calcium 2-acetyloxypropane-1,2,3-tricarboxylic acid
IUPAC Name:calcium 2-acetyloxypropane-1,2,3-tricarboxylic acid
Traditional Name:calcium 2-acetoxypropane-1,2,3-tricarboxylic acid
Formula: C8H10CaO8+2
MolecularWeight: 274.2382
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC(=O)O)(CC(=O)O)C(=O)O.[Ca+2]


Isomeric SMILES

CC(=O)OC(CC(=O)O)(CC(=O)O)C(=O)O.[Ca+2]


InChI

InChI=1S/C8H10O8.Ca/c1-4(9)16-8(7(14)15,2-5(10)11)3-6(12)13;/h2-3H2,1H3,(H,10,11)(H,12,13)(H,14,15);/q;+2


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