CHEBI:100135 - LSM-11514

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ChEBI Name LSM-11514
ChEBI ID CHEBI:100135
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H28N4O3
Net Charge 0
Average Mass 408.494
Monoisotopic Mass 408.21614
InChI InChI=1S/C23H28N4O3/c1-25(2)23(30)20-17(13-28)19-12-27-18(21(20)26(19)11-14-3-4-14)6-5-16(22(27)29)15-7-9-24-10-8-15/h5-10,14,17,19-21,28H,3-4,11-13H2,1-2H3/t17-,19-,20+,21+/m1/s1
InChIKey JAONLNNFEYMMMA-PBASOCQRSA-N
SMILES CN(C)C(=O)[C@H]1[C@@H]([C@H]2CN3C(=CC=C(C3=O)C4=CC=NC=C4)[C@@H]1N2CC5CC5)CO
ChEBI Ontology
Outgoing LSM-11514 (CHEBI:100135) is a bipyridines (CHEBI:50511)
Manual Xref Database
LSM-11514 LINCS
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