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(Q105179483)
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English
4-Hydroxy-3-(2-hydroxyethyl)acetophenone 4-glucoside
group of stereoisomers with the chemical formula C₁₆H₂₂O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
342.131467664
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₂O₈
0 references
canonical SMILES
O=C(C1=CC=C(OC2OC(CO)C(O)C(O)C2O)C(=C1)CCO)C
0 references
Identifiers
InChI
InChI=1S/C16H22O8/c1-8(19)9-2-3-11(10(6-9)4-5-17)23-16-15(22)14(21)13(20)12(7-18)24-16/h2-3,6,12-18,20-22H,4-5,7H2,1H3
0 references
InChIKey
NHMZPJFIGAJCPH-UHFFFAOYSA-N
0 references
PubChem CID
73811122
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NHMZPJFIGAJCPH-UHFFFAOYSA-N
ChEBI ID
175339
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H22O8/c1-8(19)9-2-3-11(10(6-9)4-5-17)23-16-15(22)14(21)13(20)12(7-18)24-16/h2-3,6,12-18,20-22H,4-5,7H2,1H3
UniChem compound ID
32004269
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0037552
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NHMZPJFIGAJCPH-UHFFFAOYSA-N
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