CHEBI:80828 - Gastrodin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Gastrodin
ChEBI ID CHEBI:80828
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H18O7
Net Charge 0
Average Mass 286.27780
Monoisotopic Mass 286.105
InChI InChI=1S/C13H18O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1
InChIKey PUQSUZTXKPLAPR-UJPOAAIJSA-N
SMILES OC[C@H]1O[C@@H](Oc2ccc(CO)cc2)[C@H](O)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing Gastrodin (CHEBI:80828) is a glycoside (CHEBI:24400)
Synonym Source
4-(Hydroxymethyl)phenyl-beta-D-glucopyranoside KEGG COMPOUND
Manual Xref Database
C16964 KEGG COMPOUND
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Registry Number Type Source
62499-27-8 CAS Registry Number KEGG COMPOUND