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CHEBI:131139 - LSM-42687

ChEBI IDCHEBI:131139
ChEBI NameLSM-42687
Stars
DownloadsMolfile
Formula2C25H30FN3O3
Net Charge0
Average Mass879.062
Monoisotopic Mass878.45424
SMILESCC=Cc1ccc2n(c1=O)C[C@@H]1[C@@H](CO)[C@H](C(=O)NCCC)N(Cc3cccc(F)c3)[C@H]21.CC=Cc1ccc2n(c1=O)C[C@@H]1[C@@H](CO)[C@H](C(=O)NCCC)N(Cc3cccc(F)c3)[C@H]21
InChIInChI=1S/2C25H30FN3O3/c2*1-3-6-17-9-10-21-22-19(14-28(21)25(17)32)20(15-30)23(24(31)27-11-4-2)29(22)13-16-7-5-8-18(26)12-16/h2*3,5-10,12,19-20,22-23,30H,4,11,13-15H2,1-2H3,(H,27,31)/t2*19-,20-,22+,23-/m11/s1
InChIKeyJKVQERWUMACQKR-RMMWBGDJSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-42687 (CHEBI:131139) is a amino acid amide (CHEBI:22475)
Manual XrefsDatabases
LSM-42687LINCS