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Compound	6-Shogaol
NPACT-Id	NPACT00194
IUPAC	?(E)-1-(4-hydroxy-3-methoxyphenyl)dec-4-en-3-one
Synonyms	6-Shogaol;(6)-Shogaol;[6]-Shogaol;4-DECEN-3-ONE, 1-(4-HYDROXY-3-METHOXYPHENYL)-
PubChem Id	5281794
Class	Organic chemical
In-vitro anticancer activtiy	4 cancer cell lines
In-Vivo anticancer activtiy	No
Targets	IL8 \| MMP9 \| NFKB1 \| PLAU \| TIMP1 \| VEGFA \| All \|
Properties	Physical Elemental Topological
InChi Key	OQWKEEOHDMUXEO-BQYQJAHWSA-N
InChi	1S/C17H24O3/c1-3-4-5-6-7-8-15(18)11-9-14-10-12-16(19)17(13-14)20-2/h7-8,10,12-13,19H,3-6,9,11H2,1-2H3/b8-7+
SMILES	O(c1cc(CCC(=O)/C=C/CCCCC)ccc1O)C
SMART	[H]OC1=C(OC([H])([H])[H])C([H])=C(C([H])=C1[H])C([H])([H])C([H])([H])C(=O)C([H])=C(/[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]
CAS No.	555-66-8
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C040115
	HIT	C0058
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, Ambinter, ChemMol, IS Chemical Technology, R&D Chemicals, ZINC,
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