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(Q105030657)
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English
[4-(5-Acetyloxy-6,7-dimethoxy-4-oxochromen-3-yl)phenyl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
isoflavone
0 references
mass
398.100167536
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₁₈O₈
0 references
canonical SMILES
O=C(OC=1C=CC(=CC1)C2=COC=3C=C(OC)C(OC)=C(OC(=O)C)C3C2=O)C
0 references
found in taxon
Pterocarpus angolensis
1 reference
stated in
A novel α-hydroxydihydrochalcone from the heartwood of Pterocarpus angolensis D.C.: absolute configuration, synthesis, photochemical transformations, and conversion into α-methyldeoxybenzoins
Identifiers
InChI
InChI=1S/C21H18O8/c1-11(22)28-14-7-5-13(6-8-14)15-10-27-16-9-17(25-3)20(26-4)21(29-12(2)23)18(16)19(15)24/h5-10H,1-4H3
0 references
InChIKey
HMSBILHIZHSYAC-UHFFFAOYSA-N
0 references
PubChem CID
163034350
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HMSBILHIZHSYAC-UHFFFAOYSA-N
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