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3-Hydroxy-2-pyrone
chemical compound
3-Hydroxy-2H-pyran-2-one
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
112.016043988
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅H₄O₃
0 references
canonical SMILES
C1=COC(=O)C(=C1)O
0 references
found in taxon
Actinidia chinensis
1 reference
stated in
Characterization of a nitrite scavenger, 3-hydroxy-2-pyranone, from Chinese wild plum juice
Identifiers
InChI
InChI=1S/C5H4O3/c6-4-2-1-3-8-5(4)7/h1-3,6H
0 references
InChIKey
LIPRKYKMVQPYPG-UHFFFAOYSA-N
0 references
CAS Registry Number
496-64-0
1 reference
InChIKey
LIPRKYKMVQPYPG-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=496-64-0
PubChem CID
68130
1 reference
matched by identifier from
InChIKey
InChIKey
LIPRKYKMVQPYPG-UHFFFAOYSA-N
ChEBI ID
173367
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C5H4O3/c6-4-2-1-3-8-5(4)7/h1-3,6H
UniChem compound ID
1003090
1 reference
stated in
UniChem
NMRShiftDB structure ID
20027371
1 reference
matched by identifier from
InChIKey
InChIKey
LIPRKYKMVQPYPG-UHFFFAOYSA-N
DSSTox substance ID
DTXSID00197924
1 reference
matched by identifier from
InChIKey
InChIKey
LIPRKYKMVQPYPG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60120415
0 references
Human Metabolome Database ID
HMDB0032994
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LIPRKYKMVQPYPG-UHFFFAOYSA-N
UNII
WBW7DM4PJL
1 reference
matched by identifier from
InChIKey
InChIKey
LIPRKYKMVQPYPG-UHFFFAOYSA-N
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