CHEBI:149912 - 4-Chloro-2-[5-[(Z)-[5-oxo-3-phenyl-1-(4-propan-2-ylphenyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid

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ChEBI Name 4-Chloro-2-[5-[(Z)-[5-oxo-3-phenyl-1-(4-propan-2-ylphenyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid
ChEBI ID CHEBI:149912
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000064512333
Download Molfile XML SDF
Formula C30H23ClN2O4
Net Charge 0
Average Mass 510.970
Monoisotopic Mass 510.13463
InChI InChI=1S/C30H23ClN2O4/c1-18(2)19-8-11-22(12-9-19)33-29(34)26(28(32-33)20-6-4-3-5-7-20)17-23-13-15-27(37-23)25-16-21(31)10-14-24(25)30(35)36/h3-18H,1-2H3,(H,35,36)/b26-17-
InChIKey SVQAGVLZHTXJJV-ONUIUJJFSA-N
SMILES C1=CC(=CC(=C1C(=O)O)C=2OC(=CC2)/C=C/3\C(N(N=C3C4=CC=CC=C4)C5=CC=C(C=C5)C(C)C)=O)Cl
Roles Classification
Biological Role(s): anticoronaviral agent
Any antiviral agent which inhibits the activity of coronaviruses.
(via 4-Chloro-2-[5-[(Z)-[5-oxo-3-phenyl-1-(4-propan-2-ylphenyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid )
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via diarylheptanoid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-Chloro-2-[5-[(Z)-[5-oxo-3-phenyl-1-(4-propan-2-ylphenyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid (CHEBI:149912) has role anticoronaviral agent (CHEBI:149553)
4-Chloro-2-[5-[(Z)-[5-oxo-3-phenyl-1-(4-propan-2-ylphenyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid (CHEBI:149912) is a diarylheptanoid (CHEBI:78802)
General Comment
2020-05-22 anti-coronaviral activity data of this compound obtained from ChEMBL