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(Q104250980)
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English
Obtusaquinone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
254.094294308
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₄O₃
0 references
canonical SMILES
O=C1C=C(OC)C(=CC=CC=2C=CC=CC2)C=C1O
0 references
isomeric SMILES
COC1=CC(=O)C(O)=C/C1=C\C=C\c1ccccc1
1 reference
based on heuristic
inferred from InChI
found in taxon
Dalbergia retusa
5 references
stated in
Occupational allergic contact dermatitis caused by decorative plants
stated in
Obtusastyrene and obtustyrene, cinnamylphenols from Dalbergia retusa
stated in
Quinonoid constituents of Dalbergia retusa heartwood
stated in
Obtusastyrene and obtustyrene, cinnamylphenols from Dalbergia retusa
stated in
Phenolic and quinoidal constituents of dalbergia retusa
Identifiers
InChI
InChI=1S/C16H14O3/c1-19-16-11-15(18)14(17)10-13(16)9-5-8-12-6-3-2-4-7-12/h2-11,17H,1H3/b8-5+,13-9+
0 references
InChIKey
LUZUAYAKZLCOCQ-BHHNFLQBSA-N
0 references
PubChem CID
5967872
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LUZUAYAKZLCOCQ-BHHNFLQBSA-N
SureChEMBL ID
SCHEMBL17131949
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LUZUAYAKZLCOCQ-BHHNFLQBSA-N
UniChem compound ID
700456
1 reference
stated in
UniChem
NMRShiftDB structure ID
20145066
1 reference
matched by identifier from
InChIKey
InChIKey
LUZUAYAKZLCOCQ-BHHNFLQBSA-N
KNApSAcK ID
C00020661
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LUZUAYAKZLCOCQ-BHHNFLQBSA-N
Probes And Drugs ID
PD002232
0 references
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