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(Q104989623)
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English
5-Hydroxy-6-methoxy-2-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
group of stereoisomers with the chemical formula C₂₉H₃₄O₁₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavone
1 reference
inferred from
flavone
mass
622.1897703879999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₃₄O₁₅
0 references
canonical SMILES
O=C1C=C(OC=2C=C(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)C(OC)=C(O)C12)C=5C=CC(OC)=CC5
0 references
Identifiers
InChI
InChI=1S/C29H34O15/c1-11-20(31)23(34)25(36)28(41-11)40-10-18-21(32)24(35)26(37)29(44-18)43-17-9-16-19(22(33)27(17)39-3)14(30)8-15(42-16)12-4-6-13(38-2)7-5-12/h4-9,11,18,20-21,23-26,28-29,31-37H,10H2,1-3H3
0 references
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
0 references
PubChem CID
3818047
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
UniChem compound ID
23491521
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Washington_State_Univ-BML01591
1 reference
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML01600
1 reference
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML01609
1 reference
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML01618
1 reference
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML01626
1 reference
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Washington_State_Univ-BML01634
1 reference
InChIKey
DUXQKCCELUKXOE-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
HMDB0256193
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DUXQKCCELUKXOE-UHFFFAOYSA-N
Probes And Drugs ID
PD056401
0 references
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