jdtic (CHEBI:747950)

CHEBI:747950 - jdtic

Formula	C28H39N3O3
Net Charge	0
Average Mass	465.638
Monoisotopic Mass	465.29914
SMILES	CC(C)[C@@H](CN1CC[C@@](C)(c2cccc(O)c2)[C@@H](C)C1)NC(=O)[C@H]1Cc2ccc(O)cc2CN1
InChI	InChI=1S/C28H39N3O3/c1-18(2)26(30-27(34)25-13-20-8-9-24(33)12-21(20)15-29-25)17-31-11-10-28(4,19(3)16-31)22-6-5-7-23(32)14-22/h5-9,12,14,18-19,25-26,29,32-33H,10-11,13,15-17H2,1-4H3,(H,30,34)/t19-,25+,26+,28+/m0/s1
InChIKey	ZLVXBBHTMQJRSX-VMGNSXQWSA-N

ChEBI Ontology

Outgoing Relation(s)
	jdtic (CHEBI:747950) is a piperidines (CHEBI:26151)

Synonyms	Source
Jdtic	ChEMBL
Rti-jdtic	ChEMBL

Citations