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CHEBI:181600 - Clove-3

ChEBI IDCHEBI:181600
ChEBI NameClove-3
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FormulaC16H18O9
Net Charge0
Average Mass354.311
Monoisotopic Mass354.09508
SMILES[H][C@@]1(c2c(O)cc(O)c3c(=O)cc(C)oc23)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C16H18O9/c1-5-2-6(18)10-7(19)3-8(20)11(15(10)24-5)16-14(23)13(22)12(21)9(4-17)25-16/h2-3,9,12-14,16-17,19-23H,4H2,1H3/t9-,12-,13+,14-,16+/m1/s1
InChIKeyUDTUCCXZNVRBEJ-PBVFJORSSA-N
ChEBI Ontology
Outgoing Relation(s)
Clove-3 (CHEBI:181600) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
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