Cellobionic acid

(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoic acid

Also Known As: Cellobionic acid|Maltobionate|Maltobionic acid|cellobionate|Cellobionic Acid Ammonium Salt|GlyTouCan:G31453AS|4-O-beta-D-glucopyranosyl-D-gluconic acid|534-41-8 (free base)|G31453AS|4-O-beta-D-glucosyl-D-gluconic acid|4-O-beta-D-Glucopyranosyl D-gluconic acid|4-O-beta-D-glucopyranosyl-D-gluconate|4-O-b-D-Glucopyranosyl-D-gluconic acid|Gluconic acid, 4-O-beta-D-gluconic acid|beta-D-glucosyl-(1->4)-D-gluconic acid|4-o-alpha-d-glucopyranosyl-d-gluconic acid|D-Gluconic acid, 4-O-beta-D-glucopyranosyl-|J1.846.155B|beta-D-glucopyranosyl-(1->4)-D-gluconic acid|4-O-(beta-D-Glucopyranosyl)-D-gluco-hexonic acid|2-(4-fluoro-3-trifluoromethyl-phenyl)-propan-2-ol|4-O-b-D-Glucopyranosyl-D-gluconic acid ammonium salt|(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoic acid|(2R,3R,4R,5R)-2,3,5,6-Tetrahydroxy-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexanoic acid|(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-hexanoic acid|(2R,3R,4R,5R)-2,3,5,6-TETRAHYDROXY-4-{[(2S,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}HEXANOIC ACID|CEZ

Molecular Formula	C12H22O12
Molecular Weight	358.1111 g/mol
LogP	-5.6689
Topological Polar Surface Area	217.6 Ų
Hydrogen Bond Donors	9
Hydrogen Bond Acceptors	11
Rotatable Bonds	8
Exact Mass	358.1111
Monoisotopic Mass	358.1111
Heavy Atoms	24
Complexity	403.49954

Chemical Identifiers

CAS Number	534-41-8
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