CHEBI:2780 - Apoatropine

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ChEBI Name Apoatropine
ChEBI ID CHEBI:2780
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H21NO2
Net Charge 0
Average Mass 271.355
Monoisotopic Mass 271.15723
InChI InChI=1S/C17H21NO2/c1-12(13-6-4-3-5-7-13)17(19)20-16-10-14-8-9-15(11-16)18(14)2/h3-7,14-16H,1,8-11H2,2H3
InChIKey WPUIZWXOSDVQJU-UHFFFAOYSA-N
SMILES CN1C2CCC1C[C@H](C2)OC(=O)C(=C)c1ccccc1
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 Apoatropine (CHEBI:2780) is a monocarboxylic acid (CHEBI:25384)
Synonym Source
Apoatropine KEGG COMPOUND
Manual Xrefs Databases
C00002275 KNApSAcK
C10843 KEGG COMPOUND
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Registry Number Type Source
500-55-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014