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CHEBI:6644 - Magnosalicin

ChEBI IDCHEBI:6644
ChEBI NameMagnosalicin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC24H32O7
Net Charge0
Average Mass432.513
Monoisotopic Mass432.21480
SMILESCOc1cc(OC)c([C@H]2[C@H](C)[C@@H](c3cc(OC)c(OC)cc3OC)O[C@H]2C)cc1OC
InChIInChI=1S/C24H32O7/c1-13-23(15-9-19(27-5)21(29-7)11-17(15)25-3)14(2)31-24(13)16-10-20(28-6)22(30-8)12-18(16)26-4/h9-14,23-24H,1-8H3/t13-,14-,23-,24-/m0/s1
InChIKeyXCWBENSTFQIQNV-NHCASCSRSA-N
ChEBI Ontology
Outgoing Relation(s)
Magnosalicin (CHEBI:6644) is a lignan (CHEBI:25036)
Synonym  Source
MagnosalicinKEGG COMPOUND
Manual XrefsDatabases
C10657KEGG COMPOUND
C00002612KNApSAcK
Registry NumbersSources
CAS:93376-03-5KEGG COMPOUND