CHEBI:34965 - S9947

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name S9947
ChEBI ID CHEBI:34965
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C29H27N3O3
Net Charge 0
Average Mass 465.544
Monoisotopic Mass 465.20524
InChI InChI=1S/C29H27N3O3/c33-28(31-19-17-24-13-8-9-18-30-24)27-16-7-6-15-26(27)25-14-5-4-12-23(25)20-32-29(34)35-21-22-10-2-1-3-11-22/h1-16,18H,17,19-21H2,(H,31,33)(H,32,34)
InChIKey FLOLVFLAXFXKBU-UHFFFAOYSA-N
SMILES O=C(NCc1ccccc1-c1ccccc1C(=O)NCCc1ccccn1)OCc1ccccc1
ChEBI Ontology
Outgoing S9947 (CHEBI:34965) is a biphenyls (CHEBI:22888)
Synonyms Sources
2'-(Benzyloxycarbonylaminomethyl)biphenyl-2-carboxylic acid 2-(2-pyridyl)ethylamide KEGG COMPOUND
S9947 KEGG COMPOUND
Manual Xref Database
C13771 KEGG COMPOUND
View more database links
Last Modified
28 July 2014