LSM-13578 (CHEBI:102222)

CHEBI:102222 - LSM-13578

Formula	C25H35N3O6
Net Charge	0
Average Mass	473.570
Monoisotopic Mass	473.25259
SMILES	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](OC)CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2
InChI	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22-/m1/s1
InChIKey	XYLRKRISJMFHFX-QKINTPNGSA-N

ChEBI Ontology

Outgoing Relation(s)
	LSM-13578 (CHEBI:102222) is a azamacrocycle (CHEBI:52898)
	LSM-13578 (CHEBI:102222) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-13578	LINCS