CHEBI:135549 - tiracizine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name tiracizine
ChEBI ID CHEBI:135549
Stars This entity has been manually annotated by a third party.
Supplier Information eMolecules:1360357, ZINC000000538471
Download Molfile XML SDF
Formula C21H25N3O3
Net Charge 0
Average Mass 367.442
Monoisotopic Mass 367.18959
InChI InChI=1S/C21H25N3O3/c1-4-27-21(26)22-17-12-11-16-10-9-15-7-5-6-8-18(15)24(19(16)13-17)20(25)14-23(2)3/h5-8,11-13H,4,9-10,14H2,1-3H3,(H,22,26)
InChIKey KJAMZCVTJDTESW-UHFFFAOYSA-N
SMILES C(CN(C)C)(=O)N1C=2C(CCC3=C1C=CC=C3)=CC=C(C2)NC(OCC)=O
ChEBI Ontology
Outgoing tiracizine (CHEBI:135549) is a dibenzooxazepine (CHEBI:53802)
Manual Xref Database
2679 DrugCentral
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Registry Number Type Source
83275-56-3 CAS Registry Number DrugCentral
Last Modified
23 February 2017