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Preferred Name

Gastrodin
Synonyms

4-(Hydroxymethyl)phenyl-beta-D-glucopyranoside
ID

http://purl.obolibrary.org/obo/CHEBI_80828
charge

0
database_cross_reference

CAS:62499-27-8

KEGG:C16964
formula

C13H18O7
has_obo_namespace

chebi_ontology
has_related_synonym

4-(Hydroxymethyl)phenyl-beta-D-glucopyranoside
id

CHEBI:80828
in_subset

http://purl.obolibrary.org/obo/chebi#2_STAR
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
label

Gastrodin
mass

286.27780
monoisotopicmass

286.10525
notation

CHEBI:80828
prefLabel

Gastrodin
smiles

OC[C@H]1O[C@@H](Oc2ccc(CO)cc2)[C@H](O)[C@@H](O)[C@@H]1O
treeView

http://purl.obolibrary.org/obo/CHEBI_24400
subClassOf

http://purl.obolibrary.org/obo/CHEBI_24400
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http://purl.bioontology.org/ontology/MESH/C045345 Medical Subject Headings / 医学主题词表 LOOM