CHEBI:235 - (5,12,13-Triaza-indeno[1,2-b]anthracen-13-yl)-acetic acid ethylester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (5,12,13-Triaza-indeno[1,2-b]anthracen-13-yl)-acetic acid ethylester
ChEBI ID CHEBI:235
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H17N3O2
Net Charge 0
Average Mass 355.390
Monoisotopic Mass 355.13208
InChI InChI=1S/C22H17N3O2/c1-2-27-20(26)13-25-19-10-6-5-9-16(19)21-22(25)24-18-12-15-8-4-3-7-14(15)11-17(18)23-21/h3-12H,2,13H2,1H3
InChIKey AKCPGFVZRKPWCP-UHFFFAOYSA-N
SMILES CCOC(=O)Cn1c2ccccc2c2nc3cc4ccccc4cc3nc12
ChEBI Ontology
Outgoing (5,12,13-Triaza-indeno[1,2-b]anthracen-13-yl)-acetic acid ethylester (CHEBI:235) is a ethyl ester (CHEBI:23990)
(5,12,13-Triaza-indeno[1,2-b]anthracen-13-yl)-acetic acid ethylester (CHEBI:235) is a organic heteropentacyclic compound (CHEBI:38164)
Synonym Source
(5,12,13-Triaza-indeno[1,2-b]anthracen-13-yl)-acetic acid ethyl ester KEGG COMPOUND
Manual Xref Database
C11568 KEGG COMPOUND
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Last Modified
02 March 2015