LSM-12084 (CHEBI:100710)

CHEBI:100710 - LSM-12084

Formula	C22H29N3O5
Net Charge	0
Average Mass	415.490
Monoisotopic Mass	415.21072
SMILES	CO[C@H]1CC[C@H]2CCOc3c(C#N)cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@H]1O2
InChI	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18+,19-/m1/s1
InChIKey	LYYREMJMDQKNES-TWKWOARYSA-N

ChEBI Ontology

Outgoing Relation(s)
	LSM-12084 (CHEBI:100710) is a azamacrocycle (CHEBI:52898)
	LSM-12084 (CHEBI:100710) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-12084	LINCS