CHEBI:105069 - 2-[[2-(3,4-dimethoxyphenyl)-6-methyl-1-benzopyran-4-ylidene]amino]butanoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[[2-(3,4-dimethoxyphenyl)-6-methyl-1-benzopyran-4-ylidene]amino]butanoic acid
ChEBI ID CHEBI:105069
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H23NO5
Net Charge 0
Average Mass 381.423
Monoisotopic Mass 381.15762
InChI InChI=1S/C22H23NO5/c1-5-16(22(24)25)23-17-12-20(28-18-8-6-13(2)10-15(17)18)14-7-9-19(26-3)21(11-14)27-4/h6-12,16H,5H2,1-4H3,(H,24,25)
InChIKey MSOJOKQYWZTZTD-UHFFFAOYSA-N
SMILES CCC(C(=O)O)N=C1C=C(OC2=C1C=C(C=C2)C)C3=CC(=C(C=C3)OC)OC
ChEBI Ontology
Outgoing 2-[[2-(3,4-dimethoxyphenyl)-6-methyl-1-benzopyran-4-ylidene]amino]butanoic acid (CHEBI:105069) is a ether (CHEBI:25698)
2-[[2-(3,4-dimethoxyphenyl)-6-methyl-1-benzopyran-4-ylidene]amino]butanoic acid (CHEBI:105069) is a flavonoids (CHEBI:72544)
Manual Xref Database
LSM-16432 LINCS
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