EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:101646 - LSM-13009

ChEBI IDCHEBI:101646
ChEBI NameLSM-13009
Stars
DownloadsMolfile
FormulaC27H28FN3O3
Net Charge0
Average Mass461.537
Monoisotopic Mass461.21147
SMILESCN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]1N2Cc1ccccc1
InChIInChI=1S/C27H28FN3O3/c1-29(2)27(34)24-21(16-32)23-15-31-22(25(24)30(23)14-17-7-4-3-5-8-17)12-11-20(26(31)33)18-9-6-10-19(28)13-18/h3-13,21,23-25,32H,14-16H2,1-2H3/t21-,23-,24+,25+/m1/s1
InChIKeyDPECORRGLVHITO-VGCGRUFVSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-13009 (CHEBI:101646) is a phenylpyridine (CHEBI:38193)
Manual XrefsDatabases
LSM-13009LINCS