CHEBI:112222 - 1-(3-nitrophenyl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(3-nitrophenyl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one
ChEBI ID CHEBI:112222
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C18H17NO6
Net Charge 0
Average Mass 343.331
Monoisotopic Mass 343.10559
InChI InChI=1S/C18H17NO6/c1-23-16-9-12(10-17(24-2)18(16)25-3)7-8-15(20)13-5-4-6-14(11-13)19(21)22/h4-11H,1-3H3
InChIKey OYCXONLNNCKOQR-UHFFFAOYSA-N
SMILES COC1=CC(=CC(=C1OC)OC)C=CC(=O)C2=CC(=CC=C2)[N+](=O)[O-]
ChEBI Ontology
Outgoing 1-(3-nitrophenyl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one (CHEBI:112222) is a chalcones (CHEBI:23086)
Manual Xref Database
LSM-23634 LINCS
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