calcium 2,3,4,5,6-pentakis(oxidanyl)hexyl 2-oxidanylpropanoate

Systemtic Name: calcium 2,3,4,5,6-pentakis(oxidanyl)hexyl 2-oxidanylpropanoate Openeye Name: calcium 2,3,4,5,6-pentahydroxyhexyl 2-hydroxypropanoate CAS Name: calcium 2-hydroxypropanoic acid 2,3,4,5,6-pentahydroxyhexyl ester IUPAC Name: calcium 2,3,4,5,6-pentahydroxyhexyl 2-hydroxypropanoate Traditional Name: calcium 2-hydroxypropionic acid 2,3,4,5,6-pentahydroxyhexyl ester Formula: C9H18CaO8+2 MolecularWeight: 294.31242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18O8.Ca/c1-4(11)9(16)17-3-6(13)8(15)7(14)5(12)2-10;/h4-8,10-15H,2-3H2,1H3;/q;+2