CHEBI:100364 - LSM-11739

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ChEBI Name LSM-11739
ChEBI ID CHEBI:100364
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H27F3N4O4
Net Charge 0
Average Mass 492.492
Monoisotopic Mass 492.19844
InChI InChI=1S/C24H27F3N4O4/c1-29(2)22(34)14-6-4-5-13(9-14)15-7-8-17-20-19(21(33)28-12-24(25,26)27)16(11-32)18(30(20)3)10-31(17)23(15)35/h4-9,16,18-20,32H,10-12H2,1-3H3,(H,28,33)/t16-,18-,19+,20+/m0/s1
InChIKey KOJKRQVKKNDDMT-IJXRJRJASA-N
SMILES CN1[C@H]2CN3C(=CC=C(C3=O)C4=CC(=CC=C4)C(=O)N(C)C)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC(F)(F)F
ChEBI Ontology
Outgoing LSM-11739 (CHEBI:100364) is a phenylpyridine (CHEBI:38193)
Manual Xref Database
LSM-11739 LINCS
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