Compound	Machilin G
NPACT-Id	NPACT00736
IUPAC	5-[(2S,3S,4R,5R)-5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]-1,3-benzodioxole
Synonyms	-
PubChem Id	10450921
Class	Lignans
In-vitro anticancer activity	3 cancer cell lines
In-Vivo anticancer activity	No
Targets	PLCG1 \| All \|
Properties	Physical Elemental Topological
InChi Key	HSMDOSKNXLVXIP-QVEMZERUSA-N
InChi	1S/C21H24O5/c1-12-13(2)21(15-6-8-17-19(10-15)25-11-24-17)26-20(12)14-5-7-16(22-3)18(9-14)23-4/h5-10,12-13,20-21H,11H2,1-4H3/t12-,13+,20-,21+/m1/s1
SMILES	O1[C@@H]([C@H]([C@H]([C@@H]1c1cc(OC)c(OC)cc1)C)C)c1cc2OCOc2cc1
SMART	[#6]OC1=C(O[#6])C=C(C=C1)[C@@H]1O[C@@H]([C@@H]([#6])[C@H]1[#6])C1=CC2=C(OCO2)C=C1
CAS No.	-
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	-
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	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