EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:166616 - Dichotosin

ChEBI IDCHEBI:166616
ChEBI NameDichotosin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H28O9
Net Charge0
Average Mass448.468
Monoisotopic Mass448.17333
SMILESCOc1ccc([C@@H]2CCc3c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc(OC)cc3O2)cc1
InChIInChI=1S/C23H28O9/c1-28-13-5-3-12(4-6-13)16-8-7-15-17(30-16)9-14(29-2)10-18(15)31-23-22(27)21(26)20(25)19(11-24)32-23/h3-6,9-10,16,19-27H,7-8,11H2,1-2H3/t16-,19?,20+,21-,22?,23+/m0/s1
InChIKeyMPDDNOZYQCUCDA-VXRMHVKASA-N
ChEBI Ontology
Outgoing Relation(s)
Dichotosin (CHEBI:166616) is a flavonoids (CHEBI:72544)
Dichotosin (CHEBI:166616) is a glycoside (CHEBI:24400)
IUPAC Name 
(3S,4S,6S)-2-(hydroxymethyl)-6-[[(2S)-7-methoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-5-yl]oxy]oxane-3,4,5-triol
Manual XrefsDatabases
24842664ChemSpider
LMPK12020272LIPID MAPS