Compound	neorautenol
NPACT-Id	NPACT01283
IUPAC	-
Synonyms	-
PubChem Id	11500744
Class	Flavonoid
In-vitro anticancer activity	1 cancer cell lines
In-Vivo anticancer activity	No
Targets	CASP3 \| CASP7 \| MAPK1 \| All \|
Properties	Physical Elemental Topological
InChi Key	OGFFMQWYZCTXCM-KXBFYZLASA-N
InChi	1S/C20H18O4/c1-20(2)6-5-11-7-14-17(9-16(11)24-20)22-10-15-13-4-3-12(21)8-18(13)23-19(14)15/h3-9,15,19,21H,10H2,1-2H3/t15-,19-/m0/s1
SMILES	O1[C@@H]2[C@H](c3c1cc(O)cc3)COc1c2cc2c(OC(C=C2)(C)C)c1
SMART	[H]OC1=C([H])C2=C(C([H])=C1[H])[C@]1([H])C([H])([H])OC3=C(C([H])=C4C([H])=C([H])[C@](OC4=C3[H])(C([H])([H])[H])C([H])([H])[H])[C@]1([H])O2
CAS No.	-
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C526657
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	Therapeutic Targets Database,
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