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CHEBI:176018 - Pteroside D

ChEBI IDCHEBI:176018
ChEBI NamePteroside D
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FormulaC21H30O8
Net Charge0
Average Mass410.463
Monoisotopic Mass410.19407
SMILESCc1cc2c(c(C)c1CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)C(C)(C)[C@H]2O
InChIInChI=1S/C21H30O8/c1-9-7-12-14(19(27)21(3,4)18(12)26)10(2)11(9)5-6-28-20-17(25)16(24)15(23)13(8-22)29-20/h7,13,15-18,20,22-26H,5-6,8H2,1-4H3/t13-,15-,16+,17-,18+,20-/m1/s1
InChIKeyTUGWHBZURNWRDG-LNZAMEHWSA-N
ChEBI Ontology
Outgoing Relation(s)
Pteroside D (CHEBI:176018) is a glycoside (CHEBI:24400)
IUPAC Name 
(3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one
Manual XrefsDatabases
28425575ChemSpider
Registry NumbersSources
CAS:35943-38-5ChemIDplus