CHEBI:94538 - 4-(1-pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-(1-pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone
ChEBI ID CHEBI:94538
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C17H25NO4
Net Charge 0
Average Mass 307.385
Monoisotopic Mass 307.178
InChI InChI=1S/C17H25NO4/c1-20-13-11-15(21-2)17(16(12-13)22-3)14(19)7-6-10-18-8-4-5-9-18/h11-12H,4-10H2,1-3H3
InChIKey OWYLAEYXIQKAOL-UHFFFAOYSA-N
SMILES COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC
ChEBI Ontology
Outgoing 4-(1-pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone (CHEBI:94538) is a aromatic ketone (CHEBI:76224)
Synonyms Sources
buflomedil HCl DrugCentral
buflomedil hydrochloride DrugCentral
Manual Xrefs Databases
422 DrugCentral
LSM-5365 LINCS
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Registry Number Type Source
55837-25-7 CAS Registry Number DrugCentral
Last Modified
22 February 2017