CHEBI:114196 - 3-(1,3-benzodioxol-5-yl)-5,7-dimethoxy-1-benzopyran-4-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-(1,3-benzodioxol-5-yl)-5,7-dimethoxy-1-benzopyran-4-one
ChEBI ID CHEBI:114196
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C18H14O6
Net Charge 0
Average Mass 326.301
Monoisotopic Mass 326.07904
InChI InChI=1S/C18H14O6/c1-20-11-6-15(21-2)17-16(7-11)22-8-12(18(17)19)10-3-4-13-14(5-10)24-9-23-13/h3-8H,9H2,1-2H3
InChIKey IMPPSJRGMZYGJW-UHFFFAOYSA-N
SMILES COC1=CC(=C2C(=C1)OC=C(C2=O)C3=CC4=C(C=C3)OCO4)OC
ChEBI Ontology
Outgoing 3-(1,3-benzodioxol-5-yl)-5,7-dimethoxy-1-benzopyran-4-one (CHEBI:114196) is a 7-methoxyisoflavones (CHEBI:140356)
Manual Xref Database
LSM-25647 LINCS
View more database links
Last Modified
02 April 2018