LSM-42509 (CHEBI:130961)

CHEBI:130961 - LSM-42509

Formula	C22H24N2O4S
Net Charge	0
Average Mass	412.511
Monoisotopic Mass	412.14568
SMILES	CC=Cc1ccc([C@H]2[C@H]3CN(S(=O)(=O)c4ccccc4)CC(=O)N3[C@H]2CO)cc1
InChI	InChI=1S/C22H24N2O4S/c1-2-6-16-9-11-17(12-10-16)22-19-13-23(14-21(26)24(19)20(22)15-25)29(27,28)18-7-4-3-5-8-18/h2-12,19-20,22,25H,13-15H2,1H3/t19-,20+,22+/m1/s1
InChIKey	GMPJODBFNFLBBI-URVUXULASA-N

ChEBI Ontology

Outgoing Relation(s)
	LSM-42509 (CHEBI:130961) is a azetidines (CHEBI:38777)
	LSM-42509 (CHEBI:130961) is a benzenes (CHEBI:22712)
	LSM-42509 (CHEBI:130961) is a ring assembly (CHEBI:36820)

Manual Xrefs	Databases
LSM-42509	LINCS