Compound	encelin
NPACT-Id	NPACT01196
IUPAC	-
Synonyms	Dehydrofarinosin;Farinosin, dehydro-;naphtho[2,3-b]furan-2,6(3h,4h)-dione, 3a,4a,5,8a,9,9a-hexahydro-8a-methyl-3,5-bis(methylene)-,(3ar,4ar,8as,9ar)-;
PubChem Id	72540
Class	Terpenoids
In-vitro anticancer activity	2 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	LXMUZMFQJGRVFW-NDPMZMCLSA-N
InChi	1S/C15H16O3/c1-8-10-6-11-9(2)12(16)4-5-15(11,3)7-13(10)18-14(8)17/h4-5,10-11,13H,1-2,6-7H2,3H3/t10-,11+,13-,15-/m1/s1
SMILES	O1[C@H]2[C@H](C[C@@H]3[C@](C2)(C)C=CC(=O)C3=C)C(=C)C1=O
SMART	[H]C([H])=C1C(=O)O[C@]2([H])C([H])([H])[C@]3(C([H])=C([H])C(=O)C(=C(/[H])[H])[C@]3([H])C([H])([H])[C@]12[H])C([H])([H])[H]
CAS No.	15569-50-3
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C093533
	HIT	-
	NCI-60 GI₅₀ data	15569-50-3
Suppliers	AAA Chemistry, 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