NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compoundcanthin-6-one 9-O-beta-glucopyranoside
NPACT-IdNPACT01161
IUPAC-
Synonyms6-oxo-6H-indolo[3,2,1-de]-1,5-naphthyridin-9-yl beta-glucopyranoside;6H-indolo[3,2,1-de][1,5]naphthyridin-6-one, 9-(beta-D-glucopyranosyloxy)-;9-(3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-indolo[3,2,1-de][1,5]naphthyridin-6-one;
PubChem Id637482
ClassAlkaloids
In-vitro anticancer activity 2 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyMWPUPIWCFYQPEG-LWUBGYQZSA-N
InChi1S/C20H18N2O7/c23-8-14-17(25)18(26)19(27)20(29-14)28-9-1-2-10-11-5-6-21-12-3-4-15(24)22(16(11)12)13(10)7-9/h1-7,14,17-20,23,25-27H,8H2/t14-,17-,18+,19-,20-/m1/s1
SMILESO1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc1cc2n3c4c(c2cc1)ccnc4ccc3=O)CO
SMART[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(OC2=C([H])C3=C(C([H])=C2[H])C2=C4N3C(=O)C([H])=C([H])C4=NC([H])=C2[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])O[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, 
Drug-Likeliness Filters Lipinski's rule of five   Yes
Ghose filter   No
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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