CAS: 10030-53-2 - calcium alpha-D-heptagluconate dihydrate

Formula:C₁₄H₃₀CaO₁₈

InChI:InChI=1S/C7H14O8.Ca.H2O/c8-1-2(9)3(10)4(11)5(12)6(13)7(14)15;;/h2-6,8-13H,1H2,(H,14,15);;1H2/t2-,3-,4+,5-,6-;;/m1../s1

InChI key:InChIKey=CMZLEKYHMZPZSQ-PKXGBZFFSA-N

SMILES:[Ca].O=C(O)C(O)C(O)C(O)C(O)C(O)CO.O

• Synonyms:
• <span class="text-smallcaps">D</smallcap>-glycero-<smallcap>D</span>-gulo-Heptonic acid, calcium salt (2:1), dihydrate
• <span class="text-smallcaps">D</smallcap>-glycero-<smallcap>D</span>-gulo-Heptonic acid, calcium salt, dihydrate
• calcium bis[(2R,3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoate] dihydrate (non-preferred name)