CHEBI:228871 - Forsythoside E

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Forsythoside E
ChEBI ID CHEBI:228871
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H30O12
Net Charge 0
Average Mass 462.448
Monoisotopic Mass 462.17373
InChI InChI=1S/C20H30O12/c1-8-13(23)15(25)17(27)20(31-8)30-7-12-14(24)16(26)18(28)19(32-12)29-5-4-9-2-3-10(21)11(22)6-9/h2-3,6,8,12-28H,4-5,7H2,1H3/t8-,12+,13-,14+,15+,16-,17+,18+,19+,20+/m0/s1
InChIKey QIMGUQIHCNDUKU-OJJLXHDHSA-N
SMILES O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OCCC2=CC(O)=C(O)C=C2)CO[C@@H]3O[C@H]([C@H](O)[C@@H](O)[C@H]3O)C
Metabolite of Species Details
Zea mays (NCBI:txid4577) Found in exometabolome See: MetaboLights Study
ChEBI Ontology
Outgoing Forsythoside E (CHEBI:228871) is a glycoside (CHEBI:24400)
IUPAC Name
(2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol
Manual Xref Database
58805159 ChemSpider
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