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CHEBI:101426 - LSM-12789

ChEBI IDCHEBI:101426
ChEBI NameLSM-12789
Stars
DownloadsMolfile
FormulaC31H35N3O3
Net Charge0
Average Mass497.639
Monoisotopic Mass497.26784
SMILESO=C(NC1CCCC1)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1N2CCc1ccccc1
InChIInChI=1S/C31H35N3O3/c35-20-25-27-19-34-26(16-15-24(31(34)37)22-11-5-2-6-12-22)29(28(25)30(36)32-23-13-7-8-14-23)33(27)18-17-21-9-3-1-4-10-21/h1-6,9-12,15-16,23,25,27-29,35H,7-8,13-14,17-20H2,(H,32,36)/t25-,27-,28+,29+/m1/s1
InChIKeyBONPOAJFWRGMIG-RXIOLPMVSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-12789 (CHEBI:101426) is a phenylpyridine (CHEBI:38193)
Manual XrefsDatabases
LSM-12789LINCS