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CHEBI:9046 - Scandoside methyl ester

ChEBI IDCHEBI:9046
ChEBI NameScandoside methyl ester
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H24O11
Net Charge0
Average Mass404.368
Monoisotopic Mass404.13186
SMILES[H][C@@]12C(CO)=C[C@@H](O)[C@]1([H])C(C(=O)OC)=CO[C@H]2O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C17H24O11/c1-25-15(24)7-5-26-16(10-6(3-18)2-8(20)11(7)10)28-17-14(23)13(22)12(21)9(4-19)27-17/h2,5,8-14,16-23H,3-4H2,1H3/t8-,9-,10-,11+,12-,13+,14-,16+,17+/m1/s1
InChIKeyWSGPLSDARZNMCW-LPGRTNKPSA-N
ChEBI Ontology
Outgoing Relation(s)
Scandoside methyl ester (CHEBI:9046) is a terpene glycoside (CHEBI:61777)
Synonym  Source
Scandoside methyl esterKEGG COMPOUND
Manual XrefsDatabases
C09798KEGG COMPOUND
C00003097KNApSAcK
Registry NumbersSources
CAS:27530-67-2KEGG COMPOUND