EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:8185 - Physcion 8-glucoside

ChEBI IDCHEBI:8185
ChEBI NamePhyscion 8-glucoside
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H22O10
Net Charge0
Average Mass446.408
Monoisotopic Mass446.12130
SMILESCOc1cc(O)c2c(c1)C(=O)c1cc(C)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1C2=O
InChIInChI=1S/C22H22O10/c1-8-3-10-16(19(27)15-11(17(10)25)5-9(30-2)6-12(15)24)13(4-8)31-22-21(29)20(28)18(26)14(7-23)32-22/h3-6,14,18,20-24,26,28-29H,7H2,1-2H3/t14-,18-,20+,21-,22-/m1/s1
InChIKeyWLXGUTUUWXVZNM-DQMLXFRHSA-N
ChEBI Ontology
Outgoing Relation(s)
Physcion 8-glucoside (CHEBI:8185) is a anthraquinone (CHEBI:22580)
Synonyms  Source
Physcion 8-glucosideKEGG COMPOUND
Physcion 8-O-beta-D-monoglucosideKEGG COMPOUND
Manual XrefsDatabases
C10384KEGG COMPOUND
C00002850KNApSAcK
Registry NumbersSources
CAS:26296-54-8KEGG COMPOUND