EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:9295 - styraxin

ChEBI IDCHEBI:9295
ChEBI Namestyraxin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H18O7
Net Charge0
Average Mass370.357
Monoisotopic Mass370.10525
SMILES[H][C@@]12CO[C@@H](c3ccc(O)c(OC)c3)[C@]1([H])C(=O)O[C@H]2c1ccc2c(c1)OCO2
InChIInChI=1S/C20H18O7/c1-23-15-6-11(2-4-13(15)21)19-17-12(8-24-19)18(27-20(17)22)10-3-5-14-16(7-10)26-9-25-14/h2-7,12,17-19,21H,8-9H2,1H3/t12-,17-,18+,19+/m1/s1
InChIKeyADTULSGZUFJGNI-WSFKTYETSA-N
ChEBI Ontology
Outgoing Relation(s)
styraxin (CHEBI:9295) is a lignan (CHEBI:25036)
Synonym  Source
StyraxinKEGG COMPOUND
Manual XrefsDatabases
C10887KEGG COMPOUND
C00002629KNApSAcK
Registry NumbersSources
CAS:69742-32-1KEGG COMPOUND