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CHEBI:102501 - LSM-13850

ChEBI IDCHEBI:102501
ChEBI NameLSM-13850
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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+/m0/s1
InChIKeyPYNGVIMXOMYUPN-XSEFMFLKSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-13850 (CHEBI:102501) is a phenylpyridine (CHEBI:38193)
Manual XrefsDatabases
LSM-13850LINCS