Compound	Butylated hydroxyanisole
NPACT-Id	NPACT00362
IUPAC	(3R,5R,8R,9R,10R,13R,14R,17S)-17-[(2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Synonyms	2-tert-Butyl-4-hydroxyanisole; 3-tert-Butyl-4-methoxyphenol; Butylated hydroxyanisole II; 3-tert-Butylated hydroxyanisole; 2-tert-Butyl-4-hydroxy anisole; 3-tert -Butyl-4-methoxyphenol; 3-tert-butyl-4-methoxy-phenol; 4-METHOXY-3-TERT-BUTYL-PHENOL
PubChem Id	6932
Class	Organic chemical
In-vitro anticancer activity	1 cancer cell lines
In-Vivo anticancer activity	No
Targets	BCL2 \| CASP3 \| CASP8 \| All \|
Properties	Physical Elemental Topological
InChi Key	IMOYOUMVYICGCA-UHFFFAOYSA-N
InChi	1S/C11H16O2/c1-11(2,3)9-7-8(12)5-6-10(9)13-4/h5-7,12H,1-4H3
SMILES	O(c1c(C(C)(C)C)cc(O)cc1)C
SMART	[H]OC1=C([H])C(=C(OC([H])([H])[H])C([H])=C1[H])[C@](C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]
CAS No.	25013-16-5
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	D002083
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, AKos Consulting & Solutions, Angene International, ChemFrog, Chemical Synthesis Database, ChemMol, Hangzhou APIChem Technology, MP Biomedicals, ZINC,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	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