CHEBI:111282 - LSM-22738

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-22738
ChEBI ID CHEBI:111282
Stars This entity has been manually annotated by a third party.
Supplier Information eMolecules:4621492
Download Molfile XML SDF
Formula C25H23N3O3
Net Charge 0
Average Mass 413.469
Monoisotopic Mass 413.17394
InChI InChI=1S/C25H23N3O3/c1-30-18-10-7-17(8-11-18)21-20-12-9-16-5-2-3-6-19(16)23(20)31-25-22(21)24(26)28(15-27-25)13-4-14-29/h2-3,5-12,15,21,26,29H,4,13-14H2,1H3
InChIKey KFTGCKODHJNYBX-UHFFFAOYSA-N
SMILES COC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C=C3)OC5=C2C(=N)N(C=N5)CCCO
ChEBI Ontology
Outgoing LSM-22738 (CHEBI:111282) is a organic heterotricyclic compound (CHEBI:26979)
LSM-22738 (CHEBI:111282) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-22738 LINCS
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