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CHEBI:24 - (+)-Galbacin

ChEBI IDCHEBI:24
ChEBI Name(+)-Galbacin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H20O5
Net Charge0
Average Mass340.375
Monoisotopic Mass340.13107
SMILESC[C@@H]1[C@@H](C)[C@H](c2ccc3c(c2)OCO3)O[C@H]1c1ccc2c(c1)OCO2
InChIInChI=1S/C20H20O5/c1-11-12(2)20(14-4-6-16-18(8-14)24-10-22-16)25-19(11)13-3-5-15-17(7-13)23-9-21-15/h3-8,11-12,19-20H,9-10H2,1-2H3/t11-,12-,19-,20-/m1/s1
InChIKeyQFUXQRHAJWXPGP-IIBDXVJDSA-N
ChEBI Ontology
Outgoing Relation(s)
(+)-Galbacin (CHEBI:24) is a lignan (CHEBI:25036)
Synonym  Source
(+)-GalbacinKEGG COMPOUND
Manual XrefsDatabases
C10616KEGG COMPOUND
C00002605KNApSAcK
Registry NumbersSources
CAS:61891-31-4KEGG COMPOUND