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CHEBI:176484 - 4-O-alpha-Galactopyranuronosyl-galacturonic acid

ChEBI IDCHEBI:176484
ChEBI Name4-O-alpha-Galactopyranuronosyl-galacturonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O13
Net Charge0
Average Mass370.263
Monoisotopic Mass370.07474
SMILESO=C[C@H](O)[C@@H](O)[C@@H](O[C@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)C(=O)O
InChIInChI=1S/C12H18O13/c13-1-2(14)3(15)8(7(19)10(20)21)24-12-6(18)4(16)5(17)9(25-12)11(22)23/h1-9,12,14-19H,(H,20,21)(H,22,23)/t2-,3+,4-,5+,6+,7-,8+,9-,12-/m0/s1
InChIKeySYBQLSSECRIKMJ-GYIVVZTQSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS2295)
ChEBI Ontology
Outgoing Relation(s)
4-O-alpha-Galactopyranuronosyl-galacturonic acid (CHEBI:176484) is a lipopolysaccharide (CHEBI:16412)
IUPAC Name 
(2S,3R,4S,5R,6S)-6-[(1S,2R,3R,4R)-1-carboxy-1,3,4-trihydroxy-5-oxopentan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
62989777ChemSpider