LSM-13404 (CHEBI:102044)

CHEBI:102044 - LSM-13404

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-/m0/s1
InChIKey	XYLRKRISJMFHFX-DIMUUIPOSA-N

ChEBI Ontology

Outgoing Relation(s)
	LSM-13404 (CHEBI:102044) is a azamacrocycle (CHEBI:52898)
	LSM-13404 (CHEBI:102044) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-13404	LINCS