LSM-13158 (CHEBI:101796)

CHEBI:101796 - LSM-13158

Formula	C23H31N3O5
Net Charge	0
Average Mass	429.517
Monoisotopic Mass	429.22637
SMILES	CO[C@@H]1CC[C@@H]2CCOc3c(C#N)cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2
InChI	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20+/m1/s1
InChIKey	DXVJXLONGZUJOS-RLLQIKCJSA-N

ChEBI Ontology

Outgoing Relation(s)
	LSM-13158 (CHEBI:101796) is a azamacrocycle (CHEBI:52898)
	LSM-13158 (CHEBI:101796) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-13158	LINCS