Compound	Obovatifol
NPACT-Id	NPACT00822
IUPAC	5-prop-2-enyl-3-(4-prop-2-enylphenoxy)benzene-1,2-diol
Synonyms	Obovatol;1,2-Benzenediol,5-(2-propenyl)-3-(4-(2-propenyl)phenoxy)-;obovator;4',5-Diallyl-2,3-dihydroxybiphenyl ether ;5-prop-2-enyl-3-(4-prop-2-enylphenoxy)benzene-1,2-diol
PubChem Id	100771
Class	Lignans
In-vitro anticancer activtiy	4 cancer cell lines
In-Vivo anticancer activtiy	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	OPGPFZQBCIAFLI-UHFFFAOYSA-N
InChi	1S/C18H18O3/c1-3-5-13-7-9-15(10-8-13)21-17-12-14(6-4-2)11-16(19)18(17)20/h3-4,7-12,19-20H,1-2,5-6H2
SMILES	O(c1cc(CC=C)cc(O)c1O)c1ccc(CC=C)cc1
SMART	[H]OC1=C(O[H])C(OC2=C([H])C([H])=C(C([H])=C2[H])C([H])([H])C([H])=C([H])[H])=C([H])C(=C1[H])C([H])([H])C([H])=C(/[H])[H]
CAS No.	214197-14-5
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	-
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	AAA Chemistry, ABI Chem, Kingston Chemistry,
Drug-Likeliness Filters	Lipinski's rule of five	No
	Ghose filter	Yes
	Veber filter	Yes
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase