calcium glubionate (Q5018828)

calcium; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate (English)

retrieved

14 October 2016

chemical formula

C₁₈H₃₂CaO₁₉

1 reference

language of work or name

English

title

calcium; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate (English)

retrieved

14 October 2016

canonical SMILES

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

1 reference

language of work or name

English

title

calcium; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate (English)

retrieved

14 October 2016

isomeric SMILES

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

1 reference

language of work or name

English

title

calcium; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate (English)

retrieved

14 October 2016

Identifiers

InChI

InChI=1S/C12H22O12.C6H12O7.Ca/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12;7-1-2(8)3(9)4(10)5(11)6(12)13;/h3-10,12-20H,1-2H2,(H,21,22);2-5,7-11H,1H2,(H,12,13);/q;;+2/p-2/t3-,4-,5+,6+,7-,8-,9-,10-,12+;2-,3-,4+,5-;/m11./s1

1 reference

language of work or name

English

title

calcium; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate (English)

retrieved

14 October 2016

InChIKey

YPCRNBPOUVJVMU-LCGAVOCYSA-L

1 reference

language of work or name

English

title

calcium; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate (English)

14 October 2016

1 reference

Global Substance Registration System

UNII

93H20IU3DN

language of work or name

English

title

calcium glubionate anhydrous (English)

14 October 2016

1 reference

language of work or name

English

title

Calcium glubionate (English)

14 October 2016

1 reference

language of work or name

English

title

calcium; (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; (2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate (English)

14 October 2016

1 reference

language of work or name

English

title