CHEBI:109086 - 3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid
ChEBI ID CHEBI:109086
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H14N2O3
Net Charge 0
Average Mass 330.338
Monoisotopic Mass 330.10044
InChI InChI=1S/C20H14N2O3/c23-19(24)11-10-15-13-22(16-7-2-1-3-8-16)21-20(15)18-12-14-6-4-5-9-17(14)25-18/h1-13H,(H,23,24)
InChIKey RPBVHEVTQXVWDL-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=CC(=O)O
ChEBI Ontology
Outgoing 3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid (CHEBI:109086) is a pyrazoles (CHEBI:26410)
3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid (CHEBI:109086) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-20484 LINCS
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