lanabecestat (CHEBI:756435)

CHEBI:756435 - lanabecestat

Formula	C26H28N4O
Net Charge	0
Average Mass	412.537
Monoisotopic Mass	412.22631
SMILES	CC#Cc1cncc(-c2ccc3c(c2)[C@@]2(N=C(C)C(N)=N2)[C@]2(CC[C@H](OC)CC2)C3)c1
InChI	InChI=1S/C26H28N4O/c1-4-5-18-12-21(16-28-15-18)19-6-7-20-14-25(10-8-22(31-3)9-11-25)26(23(20)13-19)29-17(2)24(27)30-26/h6-7,12-13,15-16,22H,8-11,14H2,1-3H3,(H2,27,30)/t22-,25-,26-/m0/s1
InChIKey	WKDNQONLGXOZRG-HRNNMHKYSA-N

ChEBI Ontology

Outgoing Relation(s)
	lanabecestat (CHEBI:756435) is a indanes (CHEBI:46940)

INN	Source
lanabecestat	WHO MedNet

Citations