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Compound	N-(4-hydroxyundecanoyl)anabasine
NPACT-Id	NPACT00794
IUPAC	4-hydroxy-1-(2-pyridin-3-ylpiperidin-1-yl)undecan-1-one
Synonyms	N-Ohanabas
PubChem Id	124256
Class	Alkaloids
In-vitro anticancer activtiy	2 cancer cell lines
In-Vivo anticancer activtiy	No
Targets	CYP19A1 \| All \|
Properties	Physical Elemental Topological
InChi Key	RDBZQGFWNLAFAT-UHFFFAOYSA-N
InChi	1S/C21H34N2O2/c1-2-3-4-5-6-11-19(24)13-14-21(25)23-16-8-7-12-20(23)18-10-9-15-22-17-18/h9-10,15,17,19-20,24H,2-8,11-14,16H2,1H3
SMILES	O=C(N1[C@H](CCCC1)c1cccnc1)CC[C@@H](O)CCCCCCC
SMART	[#6]CCCCCC[C@H](O)CCC(=O)N1CCCC[C@@H]1C1=CN=CC=C1
CAS No.	133201-45-3
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C085877
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	Yes
	Veber filter	Yes
	Muegge Filter	Yes
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase