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(Q82073936)
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English
9-(3,4-dimethoxyphenyl)-5-hydroxy-6H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
arylnaphthalene-type lignan
0 references
mass
380.089602852
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₁₆O₇
0 references
canonical SMILES
COC1=C(C=C(C=C1)C2=C3C(=C(C4=CC5=C(C=C42)OCO5)O)COC3=O)OC
0 references
found in taxon
Bupleurum scorzonerifolium
3 references
stated in
Immunosuppressive flavones and lignans from Bupleurum scorzonerifolium
stated in
Immunosuppressive flavones and lignans from Bupleurum scorzonerifolium
stated in
Immunosuppressive flavones and lignans from Bupleurum scorzonerifolium
Justicia ciliata
3 references
stated in
Cytotoxic lignans of Justicia ciliata
stated in
Cytotoxic lignans of Justicia ciliata
stated in
Cytotoxic lignans of Justicia ciliata
Justicia procumbens
2 references
stated in
Antiplatelet arylnaphthalide lignans from Justicia procumbens
stated in
Complete assignments of 1H and 13C NMR data for seven arylnaphthalide lignans from Justicia procumbens
Polygala glomerata
1 reference
stated in
Structure of chinensin: A new lignan lactone from Polygala chinensis
Pogonospermum ciliare
1 reference
stated in
Cytotoxic lignans of Justicia ciliata
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
0 references
Identifiers
InChI
InChI=1S/C21H16O7/c1-24-14-4-3-10(5-15(14)25-2)18-11-6-16-17(28-9-27-16)7-12(11)20(22)13-8-26-21(23)19(13)18/h3-7,22H,8-9H2,1-2H3
0 references
InChIKey
ZYUVOQCJYNAWNV-UHFFFAOYSA-N
0 references
CAS Registry Number
53965-06-3
0 references
PubChem CID
332529
1 reference
matched by identifier from
InChIKey
InChIKey
ZYUVOQCJYNAWNV-UHFFFAOYSA-N
UniChem compound ID
529761
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90318383
1 reference
matched by identifier from
InChIKey
InChIKey
ZYUVOQCJYNAWNV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70269506
0 references
NSC number
329490
0 references
KNApSAcK ID
C00036092
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZYUVOQCJYNAWNV-UHFFFAOYSA-N
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