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(Q105225642)
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English
3-({6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium
group of stereoisomers with the chemical formula C₂₃H₂₃O₁₃⁺
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavylium compound
1 reference
inferred from
flavylium compound
mass
507.11331721609
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₃O₁₃⁺
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C(OCC1OC(OC2=CC=3C(O)=CC(O)=CC3[O+]=C2C=4C=C(O)C(O)=C(O)C4)C(O)C(O)C1O)C
0 references
found in taxon
Mangifera indica
1 reference
stated in
A Study on the Expression of Genes Involved in Carotenoids and Anthocyanins During Ripening in Fruit Peel of Green, Yellow, and Red Colored Mango Cultivars.
Identifiers
InChI
InChI=1S/C23H22O13/c1-8(24)33-7-17-19(30)20(31)21(32)23(36-17)35-16-6-11-12(26)4-10(25)5-15(11)34-22(16)9-2-13(27)18(29)14(28)3-9/h2-6,17,19-21,23,30-32H,7H2,1H3,(H4-,25,26,27,28,29)/p+1
0 references
InChIKey
QPXIWIXIRHZIMM-UHFFFAOYSA-O
0 references
PubChem CID
74977044
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QPXIWIXIRHZIMM-UHFFFAOYSA-O
DSSTox substance ID
DTXSID801341467
1 reference
matched by identifier from
InChIKey
InChIKey
QPXIWIXIRHZIMM-UHFFFAOYSA-O
Human Metabolome Database ID
HMDB0303812
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QPXIWIXIRHZIMM-UHFFFAOYSA-O
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