Compound	Ligustenin A
NPACT-Id	NPACT00711
IUPAC	-
Synonyms	-
PubChem Id	-
Class	Benzofuranoids
In-vitro anticancer activtiy	3 cancer cell lines
In-Vivo anticancer activtiy	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	LRZZZUBJFXFQMD-UHFFFAOYSA-N
InChi	1S/C26H30O8/c1-15(18-8-16-9-21(30-5)22(31-6)12-20(16)33-18)13-26(2,3)25(28)34-24-10-17(14-27)19(29-4)11-23(24)32-7/h8-12,27H,1,13-14H2,2-7H3
SMILES	c1c(c(cc2c1oc(c2)C(=C)CC(C(=O)Oc1c(OC)cc(c(c1)CO)OC)(C)C)OC)OC
SMART	[#6]OC1=CC(O[#6])=C(OC(=O)[C@@]([#6])([#6])CC(=C)C2=CC3=C(O2)C=C(O[#6])C(O[#6])=C3)C=C1CO
CAS No.	-
Structure Download
Cross Refrence in other databases
	Super Natural	058749227
	CTD	-
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	NA,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	Yes
	Veber filter	No
	Muegge Filter	Yes
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase