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CHEBI:169215 - Ssioriside

ChEBI IDCHEBI:169215
ChEBI NameSsioriside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H38O12
Net Charge0
Average Mass554.589
Monoisotopic Mass554.23633
SMILESCOc1cc(CC(CO)C(COC2OCC(O)C(O)C2O)Cc2cc(OC)c(O)c(OC)c2)cc(OC)c1O
InChIInChI=1S/C27H38O12/c1-34-19-7-14(8-20(35-2)24(19)31)5-16(11-28)17(12-38-27-26(33)23(30)18(29)13-39-27)6-15-9-21(36-3)25(32)22(10-15)37-4/h7-10,16-18,23,26-33H,5-6,11-13H2,1-4H3
InChIKeyUTPBCUCEDIRSFI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Ssioriside (CHEBI:169215) is a glycoside (CHEBI:24400)
Ssioriside (CHEBI:169215) is a lignan (CHEBI:25036)
IUPAC Name 
2-[4-hydroxy-2,3-bis[(4-hydroxy-3,5-dimethoxyphenyl)methyl]butoxy]oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0038934HMDB