Compound	Aglafolin
NPACT-Id	NPACT00224
IUPAC	-
Synonyms	Aglafoline ;Methyl rocaglate ;AGLAFOLIN
PubChem Id	393601
Class	Lignans
In-vitro anticancer activity	16 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	VFTGDXPPYSWBSO-GWNOIRNCSA-N
InChi	1S/C28H28O8/c1-32-18-12-10-17(11-13-18)28-23(16-8-6-5-7-9-16)22(26(30)35-4)25(29)27(28,31)24-20(34-3)14-19(33-2)15-21(24)36-28/h5-15,22-23,25,29,31H,1-4H3/t22-,23-,25-,27+,28+/m1/s1
SMILES	O1[C@@]2([C@@](O)([C@H](O)[C@@H]([C@H]2c2ccccc2)C(=O)OC)c2c1cc(OC)cc2OC)c1ccc(OC)cc1
SMART	[H]O[C@]1([H])[C@]([H])(C(=O)OC([H])([H])[H])[C@@]([H])(C2=C([H])C([H])=C([H])C([H])=C2[H])[C@@]2(OC3=C(C(OC([H])([H])[H])=C([H])C(OC([H])([H])[H])=C3[H])[C@]12O[H])C1=C([H])C([H])=C(OC([H])([H])[H])C([H])=C1[H]
CAS No.	143901-35-3
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C077355
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	AAA Chemistry, ABI Chem,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	No
	Veber filter	Yes
	Muegge Filter	Yes
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase