CHEBI:94182 - 2-[4-[3-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]-1-oxoprop-2-enyl]phenoxy]acetic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[4-[3-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]-1-oxoprop-2-enyl]phenoxy]acetic acid
ChEBI ID CHEBI:94182
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C26H22O7
Net Charge 0
Average Mass 446.450
Monoisotopic Mass 446.13655
InChI InChI=1S/C26H22O7/c1-31-26(30)21-8-6-18(7-9-21)16-33-24-5-3-2-4-20(24)12-15-23(27)19-10-13-22(14-11-19)32-17-25(28)29/h2-15H,16-17H2,1H3,(H,28,29)
InChIKey ILGKLUQMYOATNU-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=CC(=O)C3=CC=C(C=C3)OCC(=O)O
ChEBI Ontology
Outgoing 2-[4-[3-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]-1-oxoprop-2-enyl]phenoxy]acetic acid (CHEBI:94182) is a chalcones (CHEBI:23086)
Manual Xref Database
LSM-4802 LINCS
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