Compound	Erystagallin A
NPACT-Id	NPACT00559
IUPAC	(6aS,11aS)-9-methoxy-2,10-bis(3-methylbut-2-enyl)-6,11a-dihydro-[1]benzofuro[3,2-c]chromene-3,6a-diol
Synonyms	-
PubChem Id	10410005
Class	Flavonoid
In-vitro anticancer activity	3 cancer cell lines
In-Vivo anticancer activity	No
Targets	PTPN1 \| All \|
Properties	Physical Elemental Topological
InChi Key	OOAXWUFECWLVEQ-IZZNHLLZSA-N
InChi	1S/C26H30O5/c1-15(2)6-8-17-12-19-23(13-21(17)27)30-14-26(28)20-10-11-22(29-5)18(9-7-16(3)4)24(20)31-25(19)26/h6-7,10-13,25,27-28H,8-9,14H2,1-5H3/t25-,26+/m0/s1
SMILES	O1[C@@H]2[C@](O)(c3c1c(c(OC)cc3)CC=C(C)C)COc1c2cc(c(O)c1)CC=C(C)C
SMART	[H]OC1=C(C([H])=C2C(OC([H])([H])[C@@]3(O[H])C4=C(O[C@@]23[H])C(=C(OC([H])([H])[H])C([H])=C4[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H])=C1[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H]
CAS No.	-
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	-
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	Therapeutic Targets Database,
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