EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:71507 - anthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubioside

ChEBI IDCHEBI:71507
ChEBI Nameanthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubioside
Stars
ASCII Nameanthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside
DefinitionAn anthocyanidin glucoside in which a single β-D-glucosyl residue is attached at position 5 together with an additional β-D-sambubiosyl residue attached at position 3 (R groups may be H).
Last Modified10 June 2014
SubmitterKAX
DownloadsMolfile
FormulaC32H37O19R2
Net Charge+1
Average Mass (excl. R groups)725.626
Monoisotopic Mass (excl. R groups)725.19290
SMILES*c1cc(-c2[o+]c3cc(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc(*)c1O
ChEBI Ontology
Outgoing Relation(s)
anthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubioside (CHEBI:71507) is a anthocyanidin glucoside (CHEBI:22569)
anthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubioside (CHEBI:71507) is conjugate acid of anthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubioside betaine (CHEBI:77944)
Incoming Relation(s)
anthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubioside betaine (CHEBI:77944) is conjugate base of anthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubioside (CHEBI:71507)
Synonyms  Source
anthocyanidin 5-O-β-D-glucoside 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside]SUBMITTER
anthocyanidin 5-O-β-D-glucoside 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside]sChEBI
anthocyanidin 5-O-β-D-glucoside 3-O-β-D-sambubiosidesChEBI