Compound	Nobiletin
NPACT-Id	NPACT00817
IUPAC	2-(3,4-dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one
Synonyms	Hexamethoxyflavone
PubChem Id	72344
Class	Flavonoid
In-vitro anticancer activity	10 cancer cell lines
In-Vivo anticancer activity	Yes
Targets	ABCB1 \| BAX \| BCL2L1 \| CASP3 \| CCNB1 \| CDC25C \| CDK1 \| PARP1 \| All \|
Properties	Physical Elemental Topological
InChi Key	MRIAQLRQZPPODS-UHFFFAOYSA-N
InChi	1S/C21H22O8/c1-23-13-8-7-11(9-15(13)24-2)14-10-12(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-14/h7-10H,1-6H3
SMILES	o1c2c(c(OC)c(OC)c(OC)c2OC)c(=O)cc1c1cc(OC)c(OC)cc1
SMART	[H]C1=C([H])C(=C([H])C(OC([H])([H])[H])=C1OC([H])([H])[H])C1=C([H])C(=O)C2=C(O1)C(OC([H])([H])[H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C2OC([H])([H])[H]
CAS No.	478-01-3
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C008661
	HIT	C0582
	NCI-60 GI₅₀ data	478-01-3
Suppliers	AAA Chemistry, ABI Chem, Ambinter, ChemFrog, ChemMol, Hangzhou APIChem Technology, MolPort, NIH Clinical Collection, Selleck Chemicals, TCI (Tokyo Chemical Industry), 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