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(Q105343757)
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English
[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-hydroxybenzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-hydroxybenzoate
1 reference
based on heuristic
inferred from SMILES
mass
300.084517472
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
4-Hydroxybenzoyl glucose
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₆O₈
0 references
canonical SMILES
O=C(OC1OC(CO)C(O)C(O)C1O)C2=CC=C(O)C=C2
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isomeric SMILES
O=C(O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccc(O)cc1
0 references
found in taxon
Rhodiola chrysanthemifolia
1 reference
stated in
Prolyl endopeptidase inhibitors from the underground part of Rhodiola sacra S. H. Fu.
Rhodiola sacra
1 reference
stated in
Prolyl endopeptidase inhibitors from the underground part of Rhodiola sacra S. H. Fu.
Identifiers
InChI
InChI=1S/C13H16O8/c14-5-8-9(16)10(17)11(18)13(20-8)21-12(19)6-1-3-7(15)4-2-6/h1-4,8-11,13-18H,5H2/t8-,9-,10+,11-,13-/m1/s1
0 references
InChIKey
XWTGDGASXRARSP-BZNQNGANSA-N
0 references
PubChem CID
91247492
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XWTGDGASXRARSP-BZNQNGANSA-N
UniChem compound ID
100264614
1 reference
stated in
UniChem
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