EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:102320 - LSM-13673

Default Structure
ChEBI IDCHEBI:102320
ChEBI NameLSM-13673
Stars
DownloadsMolfile
FormulaC25H29FN2O4
Net Charge0
Average Mass440.515
Monoisotopic Mass440.21114
SMILESCOC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2CC1CCCC1
InChIInChI=1S/C25H29FN2O4/c1-32-25(31)22-18(14-29)21-13-28-20(23(22)27(21)12-15-6-2-3-7-15)11-10-17(24(28)30)16-8-4-5-9-19(16)26/h4-5,8-11,15,18,21-23,29H,2-3,6-7,12-14H2,1H3/t18-,21-,22+,23+/m1/s1
InChIKeyPYNGVIMXOMYUPN-QQUTXWOLSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-13673 (CHEBI:102320) is a phenylpyridine (CHEBI:38193)
Manual XrefsDatabases
LSM-13673LINCS