EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:119447 - LSM-30896

ChEBI IDCHEBI:119447
ChEBI NameLSM-30896
Stars
DownloadsMolfile
FormulaC31H36N2O5
Net Charge0
Average Mass516.638
Monoisotopic Mass516.26242
SMILESCc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N([C@@H](C)CO)C[C@@H]2C)cc1
InChIInChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29-/m0/s1
InChIKeyPMCUDQOGLWYNQY-BOSRLCDASA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-30896 (CHEBI:119447) is a aromatic ether (CHEBI:35618)
Manual XrefsDatabases
LSM-30896LINCS