CHEBI:129245 - LSM-40796

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ChEBI Name LSM-40796
ChEBI ID CHEBI:129245
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H30N4O2
Net Charge 0
Average Mass 418.532
Monoisotopic Mass 418.23688
InChI InChI=1S/C25H30N4O2/c1-2-3-18-6-8-21(9-7-18)24-22(14-30)29(13-20-11-26-17-27-12-20)25(24)15-28(16-25)23(31)10-19-4-5-19/h2-3,6-9,11-12,17,19,22,24,30H,4-5,10,13-16H2,1H3/t22-,24+/m1/s1
InChIKey CEWJYQYGXCECNS-VWNXMTODSA-N
SMILES CC=CC1=CC=C(C=C1)[C@H]2[C@H](N(C23CN(C3)C(=O)CC4CC4)CC5=CN=CN=C5)CO
ChEBI Ontology
Outgoing LSM-40796 (CHEBI:129245) is a azetidines (CHEBI:38777)
LSM-40796 (CHEBI:129245) is a benzenes (CHEBI:22712)
LSM-40796 (CHEBI:129245) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-40796 LINCS
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