CHEBI:100825 - LSM-12199

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ChEBI Name LSM-12199 ChEBI ID CHEBI:100825 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C21H22FN3O4 Net Charge 0 Average Mass 399.416 Monoisotopic Mass 399.15943 InChI InChI=1S/C21H22FN3O4/c1-23(2)21(29)18-14(11-26)16-10-24-15(4-3-5-17(24)27)19(18)25(16)20(28)12-6-8-13(22)9-7-12/h3-9,14,16,18-19,26H,10-11H2,1-2H3/t14-,16-,18+,19+/m1/s1 InChIKey BBMUHFCQMOUBDR-JZGRTCEGSA-N SMILES CN(C)C(=O)[C@H]1[C@@H]([C@H]2CN3C(=O)C=CC=C3[C@@H]1N2C(=O)C4=CC=C(C=C4)F)CO ChEBI Ontology Outgoing LSM-12199 (CHEBI:100825) is a carbonyl compound (CHEBI:36586) LSM-12199 (CHEBI:100825) is a organohalogen compound (CHEBI:17792) Manual Xref Database LSM-12199 LINCS View more database links