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(Q105115581)
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English
3-[(E)-2-Carboxyethenyl]-5-(4-hydroxyphenyl)-4-oxo-4H-pyran-2-carboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
302.04265266
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₀O₇
0 references
canonical SMILES
O=C(O)C=CC=1C(=O)C(=COC1C(=O)O)C=2C=CC(O)=CC2
0 references
isomeric SMILES
O=C(O)/C=C/c1c(C(=O)O)occ(-c2ccc(O)cc2)c1=O
1 reference
based on heuristic
inferred from InChI
found in taxon
Aspergillus
1 reference
stated in
DPPH radical-scavenging compounds from dou-chi, a soybean fermented food
Identifiers
InChI
InChI=1S/C15H10O7/c16-9-3-1-8(2-4-9)11-7-22-14(15(20)21)10(13(11)19)5-6-12(17)18/h1-7,16H,(H,17,18)(H,20,21)/b6-5+
0 references
InChIKey
IMBFSFAPSYRTQN-AATRIKPKSA-N
0 references
PubChem CID
102417063
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IMBFSFAPSYRTQN-AATRIKPKSA-N
ChEBI ID
223639
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H10O7/c16-9-3-1-8(2-4-9)11-7-22-14(15(20)21)10(13(11)19)5-6-12(17)18/h1-7,16H,(H,17,18)(H,20,21)/b6-5+
UniChem compound ID
101121116
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA012258
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IMBFSFAPSYRTQN-AATRIKPKSA-N
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