EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:127770 - LSM-39327

ChEBI IDCHEBI:127770
ChEBI NameLSM-39327
Stars
DownloadsMolfile
FormulaC23H24FN3O3
Net Charge0
Average Mass409.461
Monoisotopic Mass409.18017
SMILESCC=Cc1ccc([C@H]2[C@H]3CN(C(=O)Nc4ccc(F)cc4)CC(=O)N3[C@H]2CO)cc1
InChIInChI=1S/C23H24FN3O3/c1-2-3-15-4-6-16(7-5-15)22-19-12-26(13-21(29)27(19)20(22)14-28)23(30)25-18-10-8-17(24)9-11-18/h2-11,19-20,22,28H,12-14H2,1H3,(H,25,30)/t19-,20+,22+/m1/s1
InChIKeyPXSSOCWCVDYTEO-URVUXULASA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-39327 (CHEBI:127770) is a azetidines (CHEBI:38777)
LSM-39327 (CHEBI:127770) is a benzenes (CHEBI:22712)
LSM-39327 (CHEBI:127770) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-39327LINCS