NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundArtemetin
NPACT-IdNPACT01141
IUPAC-
Synonyms4H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-5-hydroxy-3,6,7-trimethoxy-;5-Hydroxy-3,3',4',6,7-pentamethoxyflavone;Quercetagetin 3,6,7,3',4'-pentamethyl ether
PubChem Id5320351
ClassFlavonoid
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyRIGYMJVFEJNCKD-UHFFFAOYSA-N
InChi1S/C20H20O8/c1-23-11-7-6-10(8-12(11)24-2)18-20(27-5)17(22)15-13(28-18)9-14(25-3)19(26-4)16(15)21/h6-9,21H,1-5H3
SMILESo1c2c(c(=O)c(OC)c1c1cc(OC)c(OC)cc1)c(O)c(OC)c(OC)c2
SMART[H]OC1=C2C(=O)C(OC([H])([H])[H])=C(OC2=C([H])C(OC([H])([H])[H])=C1OC([H])([H])[H])C1=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C([H])=C1[H]
CAS No.479-90-3
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C054132
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, 
Drug-Likeliness Filters Lipinski's rule of five   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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