Compound	Erythro-austrobailignan-6
NPACT-Id	NPACT00563
IUPAC	4-[(2S,3R)-4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol
Synonyms	(+)-Anwulignan
PubChem Id	10404245
Class	Lignans
In-vitro anticancer activity	2 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	QDDILOVMGWUNGD-UONOGXRCSA-N
InChi	1S/C20H24O4/c1-13(8-15-4-6-17(21)19(10-15)22-3)14(2)9-16-5-7-18-20(11-16)24-12-23-18/h4-7,10-11,13-14,21H,8-9,12H2,1-3H3/t13-,14+/m0/s1
SMILES	O1c2cc(C[C@H]([C@H](Cc3cc(OC)c(O)cc3)C)C)ccc2OC1
SMART	[#6]OC1=C(O)C=CC(C[C@H]([#6])[C@H]([#6])CC2=CC3=C(OCO3)C=C2)=C1
CAS No.	107534-93-0
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C524650
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ZINC,
Drug-Likeliness Filters	Lipinski's rule of five	No
	Ghose filter	Yes
	Veber filter	Yes
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase