CHEBI:8481 - Propantheline

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Propantheline
ChEBI ID CHEBI:8481
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C23H30NO3
C23H30NO3
Net Charge +1
Average Mass 368.490
Monoisotopic Mass 368.22202
InChI InChI=1S/C23H30NO3/c1-16(2)24(5,17(3)4)14-15-26-23(25)22-18-10-6-8-12-20(18)27-21-13-9-7-11-19(21)22/h6-13,16-17,22H,14-15H2,1-5H3/q+1
InChIKey VVWYOYDLCMFIEM-UHFFFAOYSA-N
SMILES CC(C)[N+](C)(CCOC(=O)C1c2ccccc2Oc2ccccc12)C(C)C
ChEBI Ontology
Outgoing Propantheline (CHEBI:8481) is a xanthenes (CHEBI:38835)
Synonyms Sources
probanthine DrugCentral
Propantheline KEGG COMPOUND
propantheline bromide DrugCentral
propanthelinium DrugCentral
Manual Xrefs Databases
2293 DrugCentral
C07506 KEGG COMPOUND
HMDB0014920 HMDB
LSM-5959 LINCS
View more database links
Registry Number Type Source
298-50-0 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017