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(Q105029488)
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English
Tricin 7-glucuronoside
group of stereoisomers with the chemical formula C₂₃H₂₂O₁₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavone
1 reference
inferred from
flavone
mass
506.10604076399966
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₃H₂₂O₁₃
0 references
canonical SMILES
O=C(O)C1OC(OC2=CC(O)=C3C(=O)C=C(OC3=C2)C=4C=C(OC)C(O)=C(OC)C4)C(O)C(O)C1O
0 references
Identifiers
InChI
InChI=1S/C23H22O13/c1-32-14-3-8(4-15(33-2)17(14)26)12-7-11(25)16-10(24)5-9(6-13(16)35-12)34-23-20(29)18(27)19(28)21(36-23)22(30)31/h3-7,18-21,23-24,26-29H,1-2H3,(H,30,31)
0 references
InChIKey
HJWFFBNADKDQPV-UHFFFAOYSA-N
0 references
PubChem CID
74977751
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HJWFFBNADKDQPV-UHFFFAOYSA-N
UniChem compound ID
32007632
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN-PR309277
1 reference
InChIKey
HJWFFBNADKDQPV-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR310954
1 reference
InChIKey
HJWFFBNADKDQPV-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
Human Metabolome Database ID
HMDB0033894
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HJWFFBNADKDQPV-UHFFFAOYSA-N
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