NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundLeachianone A
NPACT-IdNPACT01247
IUPAC-
Synonyms-
PubChem Id44593449
ClassFlavonoid
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyYLTPWCZXKJSORQ-GYCJOSAFSA-N
InChi1S/C26H30O6/c1-14(2)6-7-16(15(3)4)10-19-20(28)12-21(29)25-22(30)13-24(32-26(19)25)18-9-8-17(27)11-23(18)31-5/h6,8-9,11-12,16,24,27-29H,3,7,10,13H2,1-2,4-5H3/t16-,24+/m1/s1
SMILESO1[C@@H](CC(=O)c2c1c(C[C@@H](CC=C(C)C)C(=C)C)c(O)cc2O)c1c(OC)cc(O)cc1
SMART[H]OC1=C([H])C(OC([H])([H])[H])=C(C([H])=C1[H])[C@@]1([H])OC2=C(C(O[H])=C([H])C(O[H])=C2C(=O)C1([H])[H])C([H])([H])[C@]([H])(C(=C([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C523322
HIT   -
NCI-60 GI50 data   -
Suppliers Therapeutic Targets Database, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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