CHEBI:2952 - Azidopine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Azidopine
ChEBI ID CHEBI:2952
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C27H26F3N5O5
Net Charge 0
Average Mass 557.522
Monoisotopic Mass 557.18860
InChI InChI=1S/C27H26F3N5O5/c1-4-39-25(37)21-15(2)33-16(3)22(23(21)19-7-5-6-8-20(19)27(28,29)30)26(38)40-14-13-32-24(36)17-9-11-18(12-10-17)34-35-31/h5-12,23,33H,4,13-14H2,1-3H3,(H,32,36)
InChIKey SWMHKFTXBOJETC-UHFFFAOYSA-N
SMILES CCOC(=O)C1=C(C)NC(C)=C(C1c1ccccc1C(F)(F)F)C(=O)OCCNC(=O)c1ccc(cc1)N=N#N
ChEBI Ontology
Outgoing Azidopine (CHEBI:2952) is a benzamides (CHEBI:22702)
Synonym Source
Azidopine KEGG COMPOUND
Manual Xref Database
C11282 KEGG COMPOUND
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Registry Number Type Source
90523-31-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014