EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:168337 - b-D-Glucuronopyranosyl-(1->3)-a-D-galacturonopyranosyl-(1->2)-L-rhamnose

ChEBI IDCHEBI:168337
ChEBI Nameb-D-Glucuronopyranosyl-(1->3)-a-D-galacturonopyranosyl-(1->2)-L-rhamnose
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O17
Net Charge0
Average Mass516.405
Monoisotopic Mass516.13265
SMILESCC1OC(O)C(OC2OC(C(=O)O)C(O)C(OC3OC(C(=O)O)C(O)C(O)C3O)C2O)C(O)C1O
WURCSWURCS=2.0/2,3,2/[axxxxm-1x_1-5][axxxxA-1x_1-5]/1-2-2/a2-b1_b3-c1
InChIInChI=1S/C18H28O17/c1-2-3(19)5(21)13(16(30)31-2)35-18-9(25)10(8(24)12(34-18)15(28)29)32-17-7(23)4(20)6(22)11(33-17)14(26)27/h2-13,16-25,30H,1H3,(H,26,27)(H,28,29)
InChIKeyZQXWNXNNCNMCTA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
b-D-Glucuronopyranosyl-(1->3)-a-D-galacturonopyranosyl-(1->2)-L-rhamnose (CHEBI:168337) is a oligosaccharide (CHEBI:50699)
IUPAC Name 
6-[2-carboxy-3,5-dihydroxy-6-(2,4,5-trihydroxy-6-methyloxan-3-yl)oxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0039728HMDB