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CHEBI:98612 - LSM-9991

ChEBI IDCHEBI:98612
ChEBI NameLSM-9991
Stars
Last Modified7 March 2018
DownloadsMolfile
FormulaC24H21F2N5O4
Net Charge0
Average Mass481.459
Monoisotopic Mass481.15616
SMILESO=C(NCc1cc(F)cc(F)c1)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2C(=O)c1cnccn1
InChIInChI=1S/C24H21F2N5O4/c25-14-6-13(7-15(26)8-14)9-29-23(34)21-16(12-32)19-11-30-18(2-1-3-20(30)33)22(21)31(19)24(35)17-10-27-4-5-28-17/h1-8,10,16,19,21-22,32H,9,11-12H2,(H,29,34)/t16-,19-,21+,22+/m0/s1
InChIKeyKPHBLEYIQPKXAE-NTSGDEEZSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-9991 (CHEBI:98612) is a pyrazines (CHEBI:38314)
LSM-9991 (CHEBI:98612) is a secondary carboxamide (CHEBI:140325)
LSM-9991 (CHEBI:98612) is a tertiary carboxamide (CHEBI:140326)
Manual XrefsDatabases
LSM-9991LINCS