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CHEBI:178183 - Sesaminol glucoside

ChEBI IDCHEBI:178183
ChEBI NameSesaminol glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H28O12
Net Charge0
Average Mass532.498
Monoisotopic Mass532.15808
SMILESOCC1OC(Oc2cc3c(cc2C2OCC4C(c5ccc6c(c5)OCO6)OCC24)OCO3)C(O)C(O)C1O
InChIInChI=1S/C26H28O12/c27-6-20-21(28)22(29)23(30)26(38-20)37-16-5-19-18(35-10-36-19)4-12(16)25-14-8-31-24(13(14)7-32-25)11-1-2-15-17(3-11)34-9-33-15/h1-5,13-14,20-30H,6-10H2
InChIKeyHVDZWQPYIXKSCL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arisaema erubescens (ncbitaxon:228806) bulb (BTO:0000159) MetaboLights (MTBLS2858)
ChEBI Ontology
Outgoing Relation(s)
Sesaminol glucoside (CHEBI:178183) is a glycoside (CHEBI:24400)
Sesaminol glucoside (CHEBI:178183) is a lignan (CHEBI:25036)
IUPAC Name 
2-[[6-[3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrouro[3,4-c]uran-6-yl]-1,3-benzodioxol-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0041209HMDB