Compound	Diallylsulfide
NPACT-Id	NPACT01190
IUPAC	-
Synonyms	Thioallyl ether;Garlic oil;Oil garlic;Allyl monosulfide;Diallyl thioether;1-Propene, 3,3'-thiobis-;Diallyl monosulfide;Diallyl sulphide;2-Propenyl sulphide;3,3-Thiobis(1-propene);Allium sativum;
PubChem Id	11617
Class	Organic chemical
In-vitro anticancer activity	2 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	UBJVUCKUDDKUJF-UHFFFAOYSA-N
InChi	1S/C6H10S/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H2
SMILES	S(CC=C)CC=C
SMART	[H]C([H])=C([H])C([H])([H])SC([H])([H])C([H])=C(/[H])[H]
CAS No.	592-88-1
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C038491
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, Ambinter, Angene International, ChemExper Chemical Directory, ChemFrog, ChemMol, IS Chemical Technology, MP Biomedicals, Sigma-Aldrich, TCI (Tokyo Chemical Industry), ZINC,
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