Compound	alpha-Toxicarol
NPACT-Id	NPACT01126
IUPAC	-
Synonyms	alpha-Toxicarol;
PubChem Id	442826
Class	Flavonoid
In-vitro anticancer activity	1 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	JLTNCZQNGBLBGO-MOPGFXCFSA-N
InChi	1S/C23H22O7/c1-23(2)6-5-11-15(30-23)8-13(24)20-21(25)19-12-7-16(26-3)17(27-4)9-14(12)28-10-18(19)29-22(11)20/h5-9,18-19,24H,10H2,1-4H3/t18-,19+/m1/s1
SMILES	O1[C@H]2[C@H](c3c(OC2)cc(OC)c(OC)c3)C(=O)c2c1c1c(OC(C=C1)(C)C)cc2O
SMART	[H]OC1=C([H])C2=C(C([H])=C([H])[C@](O2)(C([H])([H])[H])C([H])([H])[H])C2=C1C(=O)[C@@]1([H])C3=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C([H])=C3OC([H])([H])[C@@]1([H])O2
CAS No.	82-09-7
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C501190
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, 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