Compound	phaseollin
NPACT-Id	NPACT01291
IUPAC	-
Synonyms	3h,7h-furo(3,2-c:5,4-f')bis(1)benzopyran-10-ol, 6b,12b-dihydro-3,3-dimethyl-,(6br-cis)-;Pterocarpan;Phaseolin fungicide
PubChem Id	91572
Class	Flavonoid
In-vitro anticancer activity	1 cancer cell lines
In-Vivo anticancer activity	No
Targets	CASP3 \| CASP7 \| MAPK1 \| All \|
Properties	Physical Elemental Topological
InChi Key	LWTDZKXXJRRKDG-KXBFYZLASA-N
InChi	1S/C20H18O4/c1-20(2)8-7-14-16(24-20)6-5-12-15-10-22-17-9-11(21)3-4-13(17)19(15)23-18(12)14/h3-9,15,19,21H,10H2,1-2H3/t15-,19-/m0/s1
SMILES	O1[C@@H]2[C@H](c3c1c1c(OC(C=C1)(C)C)cc3)COc1c2ccc(O)c1
SMART	[H]OC1=C([H])C2=C(C([H])=C1[H])[C@]1([H])OC3=C(C([H])=C([H])C4=C3C([H])=C([H])[C@](O4)(C([H])([H])[H])C([H])([H])[H])[C@]1([H])C([H])([H])O2
CAS No.	13401-40-6
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C053345
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	AAA Chemistry, ABI Chem, Therapeutic Targets Database,
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