Compound	Deoxypodophyllotoxin
NPACT-Id	NPACT00495
IUPAC	(5R,5aR,8aR)-5-(3,4,5-trimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one
Synonyms	Anthricin;Desoxypodophyllotoxin;Isoanthricin;Isodeoxypodophyllotoxin
PubChem Id	345501
Class	Lignans
In-vitro anticancer activity	6 cancer cell lines
In-Vivo anticancer activity	No
Targets	TUBG1 \| All \|
Properties	Physical Elemental Topological
InChi Key	ZGLXUQQMLLIKAN-SVIJTADQSA-N
InChi	1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3/t13-,19+,20-/m0/s1
SMILES	O1C[C@H]2[C@@H]([C@@H](c3c(C2)cc2OCOc2c3)c2cc(OC)c(OC)c(OC)c2)C1=O
SMART	[H]C1=C2C(=C([H])C3=C1OC([H])([H])O3)[C@@]([H])(C1=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C1[H])[C@@]1([H])C(=O)OC([H])([H])[C@]1([H])C2([H])[H]
CAS No.	19186-35-7
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C014451
	HIT	C0528
	NCI-60 GI₅₀ data	19186-35-7
Suppliers	ABI Chem,
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