CHEBI:135361 - methscopolamine

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name methscopolamine ChEBI ID CHEBI:135361 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H24NO4 Net Charge +1 Average Mass 318.388 Monoisotopic Mass 318.16998 InChI InChI=1S/C18H24NO4/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11/h3-7,12-17,20H,8-10H2,1-2H3/q+1/t12-,13-,14-,15+,16-,17+/m1/s1 InChIKey LZCOQTDXKCNBEE-IKIFYQGPSA-N SMILES C[N+]1(C)[C@@H]2[C@H]3[C@@H]([C@H]1C[C@H](C2)OC([C@H](CO)C4=CC=CC=C4)=O)O3 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing methscopolamine (CHEBI:135361) is a 3-hydroxy carboxylic acid (CHEBI:61355) Synonyms Sources methscopolamine bromide DrugCentral methscopolamine nitrate DrugCentral methylscopolamine DrugCentral methylscopolamine bromide DrugCentral N-Methylhyoscine DrugCentral N-Methylscopolamine DrugCentral Manual Xrefs Databases 1757 DrugCentral HMDB0014605 HMDB View more database links Registry Number Type Source 13265-10-6 CAS Registry Number DrugCentral Last Modified 23 February 2017