Compound	Nectandrin B
NPACT-Id	NPACT00803
IUPAC	4-[(2R,3R,4S,5S)-5-(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenol
Synonyms	4-[(2R,3R,4S,5S)-5-(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenol;Phenol, 4,4'-((2R,3R,4S,5S)-tetrahydro-3,4-dimethyl-2,5-furandiyl)bis(2-methoxy-, rel-
PubChem Id	156517
Class	Lignans
In-vitro anticancer activity	4 cancer cell lines
In-Vivo anticancer activity	No
Targets	PLCG1 \| All \|
Properties	Physical Elemental Topological
InChi Key	GMXMKSFJQLFOSO-JARDSOJUSA-N
InChi	1S/C20H24O5/c1-11-12(2)20(14-6-8-16(22)18(10-14)24-4)25-19(11)13-5-7-15(21)17(9-13)23-3/h5-12,19-22H,1-4H3/t11-,12+,19-,20+
SMILES	O1[C@H]([C@@H]([C@@H]([C@H]1c1cc(OC)c(O)cc1)C)C)c1cc(OC)c(O)cc1
SMART	[H]OC1=C(OC([H])([H])[H])C([H])=C(C([H])=C1[H])[C@]1([H])O[C@]([H])(C2=C([H])C(OC([H])([H])[H])=C(O[H])C([H])=C2[H])[C@@]([H])(C([H])([H])[H])[C@@]1([H])C([H])([H])[H]
CAS No.	74683-16-2
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	-
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, ZINC,
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