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CHEBI:181828 - Teucardoside

ChEBI IDCHEBI:181828
ChEBI NameTeucardoside
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FormulaC21H30O13
Net Charge0
Average Mass490.458
Monoisotopic Mass490.16864
SMILES[H][C@@]12C(C)=CC(=O)[C@]1(O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)C=CO[C@H]2O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C21H30O13/c1-7-5-10(23)21(34-20-17(29)14(26)12(24)8(2)31-20)3-4-30-18(11(7)21)33-19-16(28)15(27)13(25)9(6-22)32-19/h3-5,8-9,11-20,22,24-29H,6H2,1-2H3/t8-,9+,11-,12-,13+,14+,15-,16+,17+,18-,19-,20-,21+/m0/s1
InChIKeyWDMQLCVSWBENIY-QZTRPTDZSA-N
ChEBI Ontology
Outgoing Relation(s)
Teucardoside (CHEBI:181828) is a glycoside (CHEBI:24400)
Teucardoside (CHEBI:181828) is a iridoid monoterpenoid (CHEBI:50563)
IUPAC Name 
(1S,4aS,7aR)-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,7a-dihydrocyclopenta[c]pyran-5-one
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297781ChemSpider