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(Q105223456)
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English
Picraquassioside B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-[4,7-Dimethoxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-5-yl]propanoic acid
1 reference
based on heuristic
inferred from SMILES
mass
428.131861588
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₄O₁₁
0 references
canonical SMILES
O=C(O)CCC=1C(OC)=C2C=COC2=C(OC)C1OC3OC(CO)C(O)C(O)C3O
0 references
isomeric SMILES
COc1c(CCC(=O)O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c2occc12
0 references
found in taxon
Picrasma quassioides
1 reference
stated in
Phenylpropanoids and other secondary metabolites from fresh fruits of Picrasma quassioides
Identifiers
InChI
InChI=1S/C19H24O11/c1-26-15-8(3-4-11(21)22)17(18(27-2)16-9(15)5-6-28-16)30-19-14(25)13(24)12(23)10(7-20)29-19/h5-6,10,12-14,19-20,23-25H,3-4,7H2,1-2H3,(H,21,22)/t10-,12-,13+,14-,19+/m1/s1
0 references
InChIKey
QLBFQDMGRBRSSW-DNYZQHFQSA-N
0 references
PubChem CID
10432711
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QLBFQDMGRBRSSW-DNYZQHFQSA-N
UniChem compound ID
34014031
1 reference
stated in
UniChem
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