CHEBI:100051 - LSM-11430

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-11430
ChEBI ID CHEBI:100051
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H28FN3O3
Net Charge 0
Average Mass 461.529
Monoisotopic Mass 461.21147
InChI InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20-,23-,24+,25+/m1/s1
InChIKey XOPHINQZQCNQKH-XDPKZGBUSA-N
SMILES C[C@H](C1=CC=CC=C1)NC(=O)[C@H]2[C@@H]([C@H]3CN4C(=CC=C(C4=O)C5=CC=CC=C5F)[C@@H]2N3C)CO
ChEBI Ontology
Outgoing LSM-11430 (CHEBI:100051) is a phenylpyridine (CHEBI:38193)
Manual Xref Database
LSM-11430 LINCS
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