Compound	Rotenone
NPACT-Id	NPACT00929
IUPAC	-
Synonyms	Derris
PubChem Id	6758
Class	Flavonoid
In-vitro anticancer activity	1 cancer cell lines
In-Vivo anticancer activity	No
Targets	CYP19A1 \| NDUFS1 \| All \|
Properties	Physical Elemental Topological
InChi Key	JUVIOZPCNVVQFO-HBGVWJBISA-N
InChi	1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16,20-21H,1,8,10H2,2-4H3/t16-,20-,21+/m1/s1
SMILES	O1[C@H]2[C@H](c3c(OC2)cc(OC)c(OC)c3)C(=O)c2c1c1C[C@@H](Oc1cc2)C(=C)C
SMART	[H]C([H])=C(C([H])([H])[H])[C@]1([H])OC2=C(C3=C(C([H])=C2[H])C(=O)[C@@]2([H])C4=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C([H])=C4OC([H])([H])[C@@]2([H])O3)C1([H])[H]
CAS No.	-
Structure Download
Cross Refrence in other databases
	Super Natural	000083794
	CTD	D012402
	HIT	C0444
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, AKos Consulting & Solutions, Ambinter, Calbiochem, ChemExper Chemical Directory, MolPort, Sigma-Aldrich, TimTec,
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