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(Q105026978)
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English
1-[4-Chloro-1-hydroxy-3-methyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone
group of stereoisomers with the chemical formula C₁₉H₂₁ClO₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
412.092495312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₁ClO₈
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canonical SMILES
O=C(C1=C(O)C=2C(OC3OC(CO)C(O)C(O)C3O)=CC=CC2C(Cl)=C1C)C
0 references
found in taxon
Rumex patientia
2 references
stated in
The structures of antioxidant and cytotoxic agents from natural source: anthraquinones and tannins from roots of Rumex patientia
stated in
Five naphthalene glycosides from the roots of Rumex patientia
Identifiers
InChI
InChI=1S/C19H21ClO8/c1-7-12(8(2)22)16(24)13-9(14(7)20)4-3-5-10(13)27-19-18(26)17(25)15(23)11(6-21)28-19/h3-5,11,15,17-19,21,23-26H,6H2,1-2H3
0 references
InChIKey
HEPVWAFOECZRTB-UHFFFAOYSA-N
0 references
PubChem CID
85359141
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HEPVWAFOECZRTB-UHFFFAOYSA-N
UniChem compound ID
32009933
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0037098
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HEPVWAFOECZRTB-UHFFFAOYSA-N
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