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(Q110081900)
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English
[6-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate
group of stereoisomers with the chemical formula C₂₃H₂₃O₁₂⁺
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Statements
instance of
group of stereoisomers
0 references
subclass of
organic cation
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mass
491.11840259609
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₃O₁₂⁺
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C(OCC1OC(OC2=CC=3C(O)=CC(O)=CC3[O+]=C2C=4C=CC(O)=C(O)C4)C(O)C(O)C1O)C
0 references
found in taxon
Allium
1 reference
stated in
Covalent anthocyanin-flavonol complexes from flowers of chive, Allium schoenoprasum
Vitis vinifera
1 reference
stated in
Novel aspects of grape berry ripening and post-harvest withering revealed by untargeted LC-ESI-MS metabolomics analysis
Identifiers
InChI
InChI=1S/C23H22O12/c1-9(24)32-8-18-19(29)20(30)21(31)23(35-18)34-17-7-12-14(27)5-11(25)6-16(12)33-22(17)10-2-3-13(26)15(28)4-10/h2-7,18-21,23,29-31H,8H2,1H3,(H3-,25,26,27,28)/p+1
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InChIKey
HBXXDBKJLPLXPR-UHFFFAOYSA-O
0 references
PubChem CID
74975034
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HBXXDBKJLPLXPR-UHFFFAOYSA-O
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