NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundVismiaguianin A
NPACT-IdNPACT01374
IUPAC-
Synonyms10-Hydroxy-8-methoxy-3,3,5-trimethyl-3H-4,11-dioxa-chrysen-12-one;10-hydroxy-8-methoxy-3,3,5-trimethyl-3H,12H-benzo[h]pyrano[3,2-c]chromen-12-one;3H,12H-naphtho[1,2-b]pyrano[2,3-d]pyran-12-one, 10-hydroxy-8-methoxy-3,3,5-trimethyl-;
PubChem Id5324262
ClassBenzopyranoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyOGTVKOGEJPVHQE-UHFFFAOYSA-N
InChi1S/C20H18O5/c1-10-7-11-8-12(23-4)9-14(21)16(11)18-15(10)17-13(19(22)24-18)5-6-20(2,3)25-17/h5-9,21H,1-4H3
SMILESO1C(C=Cc2c1c1c(oc2=O)c2c(cc1C)cc(OC)cc2O)(C)C
SMART[H]OC1=C2C(=C([H])C(OC([H])([H])[H])=C1[H])C([H])=C(C1=C2OC(=O)C2=C1O[C@](C([H])=C2[H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
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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