CHEBI:107689 - 2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid (2-oxo-3-oxolanyl) ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid (2-oxo-3-oxolanyl) ester
ChEBI ID CHEBI:107689
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H19NO6
Net Charge 0
Average Mass 393.390
Monoisotopic Mass 393.12124
InChI InChI=1S/C22H19NO6/c1-26-18-8-7-13(11-20(18)27-2)17-12-15(14-5-3-4-6-16(14)23-17)21(24)29-19-9-10-28-22(19)25/h3-8,11-12,19H,9-10H2,1-2H3
InChIKey OKPMCWIIYRPBPE-UHFFFAOYSA-N
SMILES COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4CCOC4=O)OC
ChEBI Ontology
Outgoing 2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid (2-oxo-3-oxolanyl) ester (CHEBI:107689) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-19068 LINCS
View more database links