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(Q110204867)
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English
2-(3,4-Dihydroxyphenyl)-5,8-dihydroxy-7-methoxy-3-[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 C₂₈H₃₂O₁₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
640.163949564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₃₂O₁₇
0 references
canonical SMILES
O=C1C(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)=C(OC4=C(O)C(OC)=CC(O)=C14)C=5C=CC(O)=C(O)C5
0 references
found in taxon
Ruta graveolen
1 reference
stated in
Identification of two Gossypetin Monomethyl Ethers as Yellow Flower Pigments in the Rutaceae
Identifiers
InChI
InChI=1S/C28H32O17/c1-8-16(32)20(36)22(38)27(42-8)41-7-14-17(33)21(37)23(39)28(43-14)45-26-19(35)15-12(31)6-13(40-2)18(34)25(15)44-24(26)9-3-4-10(29)11(30)5-9/h3-6,8,14,16-17,20-23,27-34,36-39H,7H2,1-2H3
0 references
InChIKey
AWDJLPGVCMQRAF-UHFFFAOYSA-N
0 references
PubChem CID
74978543
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
32018749
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0037358
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AWDJLPGVCMQRAF-UHFFFAOYSA-N
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