EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:125910 - LSM-37477

ChEBI IDCHEBI:125910
ChEBI NameLSM-37477
Stars
DownloadsMolfile
FormulaC21H27F3N2O3
Net Charge0
Average Mass412.452
Monoisotopic Mass412.19738
SMILESCC=Cc1ccc([C@H]2[C@@H](CO)N(CCC(F)(F)F)C23CN(C(=O)COC)C3)cc1
InChIInChI=1S/C21H27F3N2O3/c1-3-4-15-5-7-16(8-6-15)19-17(11-27)26(10-9-21(22,23)24)20(19)13-25(14-20)18(28)12-29-2/h3-8,17,19,27H,9-14H2,1-2H3/t17-,19+/m1/s1
InChIKeyWAHADWBAURCFAY-MJGOQNOKSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-37477 (CHEBI:125910) is a azetidines (CHEBI:38777)
LSM-37477 (CHEBI:125910) is a benzenes (CHEBI:22712)
LSM-37477 (CHEBI:125910) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-37477LINCS