Compound	Cresol
NPACT-Id	NPACT00442
IUPAC	(2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid
Synonyms	m-cresol; o-cresol; p-cresol; 2-methylphenol; 3-methylphenol; 4-methylphenol; Methylphenol tricresol
PubChem Id	24693
Class	Terpenoids
In-vitro anticancer activity	1 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	QTWJRLJHJPIABL-UHFFFAOYSA-N
InChi	1S/3C7H8O/c1-6-2-4-7(8)5-3-6;1-6-3-2-4-7(8)5-6;1-6-4-2-3-5-7(6)8/h3*2-5,8H,1H3
SMILES	Oc1c(cccc1)C.Oc1cc(ccc1)C.Oc1ccc(cc1)C
SMART	[H]OC1=C([H])C([H])=C(C([H])=C1[H])C([H])([H])[H].[H]OC1=C([H])C([H])=C([H])C(=C1[H])C([H])([H])[H].[H]OC1=C([H])C([H])=C([H])C([H])=C1C([H])([H])[H]
CAS No.	106-44-5
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C077977
	HIT	C0567
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, Amadis Chemical, ChemFrog, Sigma-Aldrich,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	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