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CHEBI:49912 - TRIGALACTURONIC ACID

Default Structure
ChEBI IDCHEBI:49912
ChEBI NameTRIGALACTURONIC ACID
Stars
DownloadsMolfile
FormulaC18H26O19
Net Charge0
Average Mass546.387
Monoisotopic Mass546.10683
SMILES[H]OC(=O)[C@@]1([H])O[C@@]([H])(O[C@]2([H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]([H])(O[C@]3([H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]([H])(O[H])O[C@]3([H])C(=O)O[H])O[C@]2([H])C(=O)O[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]1([H])O[H]
InChIInChI=1S/C18H26O19/c19-1-2(20)10(13(26)27)36-17(6(1)24)35-9-4(22)7(25)18(37-12(9)15(30)31)34-8-3(21)5(23)16(32)33-11(8)14(28)29/h1-12,16-25,32H,(H,26,27)(H,28,29)(H,30,31)/t1-,2+,3+,4+,5+,6+,7+,8+,9+,10-,11-,12-,16-,17+,18-/m0/s1
InChIKeyLCLHHZYHLXDRQG-ZZHDOSMQSA-N
ChEBI Ontology
Outgoing Relation(s)
TRIGALACTURONIC ACID (CHEBI:49912) is a unclassifieds (CHEBI:27189)
Synonyms  Source
beta-D-galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronic acidPDBeChem
TRIGALACTURONIC ACIDPDBeChem
Manual XrefsDatabases
TGUPDBeChem