EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:233490 - delta-CEHC glucuronide

Default Structure
ChEBI IDCHEBI:233490
ChEBI Namedelta-CEHC glucuronide
Stars
Submittermwilliams
DownloadsMolfile
FormulaC20H26O10
Net Charge0
Average Mass426.418
Monoisotopic Mass426.15260
SMILESCc1cc(O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc2c1OC(C)(CCC(=O)O)CC2
InChIInChI=1S/C20H26O10/c1-9-7-11(28-19-15(25)13(23)14(24)17(29-19)18(26)27)8-10-3-5-20(2,30-16(9)10)6-4-12(21)22/h7-8,13-15,17,19,23-25H,3-6H2,1-2H3,(H,21,22)(H,26,27)/t13-,14-,15+,17-,19+,20?/m0/s1
InChIKeyUCCZSQROJUPRKT-LJCLCSBPSA-N
ChEBI Ontology
Outgoing Relation(s)
delta-CEHC glucuronide (CHEBI:233490) has functional parent delta-CEHC (CHEBI:193172)
delta-CEHC glucuronide (CHEBI:233490) is a 1-benzopyran (CHEBI:38443)
delta-CEHC glucuronide (CHEBI:233490) is a glucosiduronic acid (CHEBI:24302)
delta-CEHC glucuronide (CHEBI:233490) is a lipopolysaccharide (CHEBI:16412)