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CHEBI:197410 - Excelside A

ChEBI IDCHEBI:197410
ChEBI NameExcelside A
Stars
DefinitionExcelside A is a natural product found in Fraxinus excelsior
Last Modified7 November 2024
Submitterntejera
DownloadsMolfile
FormulaC24H36O16
Net Charge0
Average Mass580.536
Monoisotopic Mass580.20034
SMILESC/C=C1/C(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)OC
InChIInChI=1S/C24H36O16/c1-4-9-10(5-14(26)34-2)11(21(33)35-3)7-36-22(9)40-24-20(32)18(30)16(28)13(39-24)8-37-23-19(31)17(29)15(27)12(6-25)38-23/h4,7,10,12-13,15-20,22-25,27-32H,5-6,8H2,1-3H3/b9-4+/t10-,12+,13+,15+,16+,17-,18-,19+,20+,22?,23+,24-/m0/s1
InChIKeyKIYJRYWOZVDCRC-GLYOJDOWSA-N
Species of MetaboliteComponentSourceComments
Fraxinus pennsylvanica (ncbitaxon:56036) - DOI (10.3389/ffgc.2023.1166421)
ChEBI Ontology
Outgoing Relation(s)
Excelside A (CHEBI:197410) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
methyl (4S,5E)-5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4H-pyran-3-carboxylate