EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:215883 - Norlichexanthone-6-O-beta-(4-O-methylglucopyranoside)

ChEBI IDCHEBI:215883
ChEBI NameNorlichexanthone-6-O-beta-(4-O-methylglucopyranoside)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O10
Net Charge0
Average Mass434.397
Monoisotopic Mass434.12130
SMILESCO[C@H]1C(CO)O[C@@H](Oc2cc(C)c3c(=O)c4c(O)cc(O)cc4oc3c2)[C@@H](O)[C@H]1O
InChIInChI=1S/C21H22O10/c1-8-3-10(29-21-19(27)18(26)20(28-2)14(7-22)31-21)6-13-15(8)17(25)16-11(24)4-9(23)5-12(16)30-13/h3-6,14,18-24,26-27H,7H2,1-2H3/t14?,18-,19+,20+,21-/m1/s1
InChIKeyGOGTZFIXPWXNHH-SIKGKWMMSA-N
Species of MetaboliteComponentSourceComments
Torrubiella (ncbitaxon:153665) - PubMed (17917241)
ChEBI Ontology
Outgoing Relation(s)
Norlichexanthone-6-O-beta-(4-O-methylglucopyranoside) (CHEBI:215883) is a xanthones (CHEBI:51149)
IUPAC Name 
6-[(2S,3S,4R,5R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-1,3-dihydroxy-8-methylxanthen-9-one