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CHEBI:7888 - Paederoside

ChEBI IDCHEBI:7888
ChEBI NamePaederoside
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC18H22O11S
Net Charge0
Average Mass446.430
Monoisotopic Mass446.08828
SMILES[H][C@@]12C3=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@]1([H])C(COC(=O)SC)=C[C@]2([H])OC3=O
InChIInChI=1S/C18H22O11S/c1-30-18(24)26-4-6-2-8-11-7(15(23)27-8)5-25-16(10(6)11)29-17-14(22)13(21)12(20)9(3-19)28-17/h2,5,8-14,16-17,19-22H,3-4H2,1H3/t8-,9+,10+,11-,12+,13-,14+,16-,17-/m0/s1
InChIKeyOJISWUQNQQWEND-FCVLBCLDSA-N
ChEBI Ontology
Outgoing Relation(s)
Paederoside (CHEBI:7888) is a glycoside (CHEBI:24400)
Synonym  Source
PaederosideKEGG COMPOUND
Manual XrefsDatabases
C09795KEGG COMPOUND
C00003094KNApSAcK
Registry NumbersSources
CAS:20547-45-9KEGG COMPOUND