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Englisch
6-(1,6-dihydroxyheptyl)-4-methoxypyran-2-one
group of stereoisomers with the chemical formula C₁₃H₂₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
256.13107374
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₀O₅
0 references
canonical SMILES
O=C1OC(=CC(OC)=C1)C(O)CCCCC(O)C
0 references
found in taxon
Xylaria
1 reference
stated in
Effect of Culture Conditions on Metabolite Production of Xylaria sp.
Identifiers
InChI
InChI=1S/C13H20O5/c1-9(14)5-3-4-6-11(15)12-7-10(17-2)8-13(16)18-12/h7-9,11,14-15H,3-6H2,1-2H3
0 references
InChIKey
PPHQORYVRYIOEI-UHFFFAOYSA-N
0 references
PubChem CID
139588262
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
PPHQORYVRYIOEI-UHFFFAOYSA-N
ChEBI ID
210458
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H20O5/c1-9(14)5-3-4-6-11(15)12-7-10(17-2)8-13(16)18-12/h7-9,11,14-15H,3-6H2,1-2H3
UniChem compound ID
170911282
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA018562
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PPHQORYVRYIOEI-UHFFFAOYSA-N
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