alpha-D-GalpA-(1->4)-alpha-D-GalpA-(1->4)-alpha-D-GalpA

(2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-carboxy-6-[(2S,3R,4R,5R,6S)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Also Known As: pectate|Polypectate|Trigalacturonic acid|pectin trisaccharide|Polygalacturonic Acid|ADA-ADA-ADA|GlyTouCan:G29175YU|G29175YU|alpha-D-GalpA-(1->4)-alpha-D-GalpA-(1->4)-alpha-D-GalpA|alpha-D-GalA-(1->4)-alpha-D-GalA-(1->4)-alpha-D-GalA|alpha-D-galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronic acid|alpha-D-galacturonosyl-(1->4)-alpha-D-galacturonosyl-(1->4)-alpha-D-galactnuronic acid|(2S,3R,4R,5R,6S)-3-{[(2S,3R,4R,5R,6S)-6-CARBOXY-5-{[(2S,3R,4S,5R,6S)-6-CARBOXY-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}-3,4-DIHYDROXYOXAN-2-YL]OXY}-4,5,6-TRIHYDROXYOXANE-2-CARBOXYLIC ACID|(2S,3R,4S,5R,6S)-6-((2S,3R,4R,5R,6S)-2-carboxy-6-((2S,3R,4R,5R,6S)-2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy-4,5-dihydroxyoxan-3-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid|(2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-carboxy-6-[(2S,3R,4R,5R,6S)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid|4-O-[4-O-(alpha-D-Galactopyranuronosyl)-(alpha-D-galactopyranuronosyl)]-alpha-D-galactopyranuronic acid|4-O-[4-O-(alpha-D-Galactopyranuronosyl)-alpha-D-galactopyranuronosyl]-alpha-D-galactopyranuronic acid

Molecular Formula	C18H26O19
Molecular Weight	546.1068 g/mol
LogP	-7.2961
Topological Polar Surface Area	319.89 Ų
Hydrogen Bond Donors	11
Hydrogen Bond Acceptors	16
Rotatable Bonds	7
Exact Mass	546.1068
Monoisotopic Mass	546.1068
Heavy Atoms	37
Complexity	852.8754

Chemical Identifiers

CAS Number	40307-13-9
SMILES	[C@@H]1([C@H]([C@H](O[C@@H]([C@@H]1O)O[C@@H]2[C@@H]([C@H]([C@H](O[C@@H]2C(=O)O)O[C@@H]3[C@@H]([C@H]([C@H](O[C@@H]3C(=O)O)O)O)O)O)O)C(=O)O)O)O