Compound	Parthenolide
NPACT-Id	NPACT00844
IUPAC	-
Synonyms	(-)-Parthenolide
PubChem Id	6473881
Class	Terpenoids
In-vitro anticancer activity	5 cancer cell lines
In-Vivo anticancer activity	No
Targets	IL1B \| NFKB1 \| All \|
Properties	Physical Elemental Topological
InChi Key	KTEXNACQROZXEV-SLXBATTESA-N
InChi	1S/C15H20O3/c1-9-5-4-8-15(3)13(18-15)12-11(7-6-9)10(2)14(16)17-12/h5,11-13H,2,4,6-8H2,1,3H3/b9-5+/t11-,12-,13-,15+/m0/s1
SMILES	O1[C@]2([C@@H]1[C@H]1OC(=O)C(=C)[C@@H]1CCC(=CCC2)C)C
SMART	[H]C([H])=C1C(=O)O[C@]2([H])[C@]3([H])O[C@]3(C([H])([H])[H])C([H])([H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]12[H]
CAS No.	20554-84-1
Structure Download
Cross Refrence in other databases
	Super Natural	020554841
	CTD	C002669
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	Ambinter, MolPort, R&D Chemicals, Selleck Chemicals, 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