Compound	Friedelin
NPACT-Id	NPACT00586
IUPAC	4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one
Synonyms	Friedelan-3-one;4,4a,6b,8a,11,11,12b,14a-octamethylicosahydropicen-3(2h)-one;Friedlein
PubChem Id	244297
Class	Terpenoids
In-vitro anticancer activity	4 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	OFMXGFHWLZPCFL-UHFFFAOYSA-N
InChi	1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3
SMILES	O=C1[C@H]([C@@]2([C@H]([C@@]3([C@@H]([C@]4([C@@]([C@@H]5[C@@](CC4)(CCC(C5)(C)C)C)(CC3)C)C)CC2)C)CC1)C)C
SMART	[H]C([H])([H])[C@]1([H])C(=O)C([H])([H])C([H])([H])[C@]2([H])[C@]1(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]1([H])[C@]2(C([H])([H])[H])C([H])([H])C([H])([H])[C@]2(C([H])([H])[H])[C@@]3([H])C([H])([H])[C@@](C([H])([H])[H])(C([H])([H])[H])C([H])([H])C([H])([H])[C@]3(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]12C([H])([H])[H]
CAS No.	559-74-0
Structure Download
Cross Refrence in other databases
	Super Natural	000559740
	CTD	C060796
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	AAA Chemistry, ABI Chem, ChemFrog,
Drug-Likeliness Filters	Lipinski's rule of five	No
	Ghose filter	No
	Veber filter	Yes
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase