NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compoundtaiwanin C
NPACT-IdNPACT01341
IUPAC-
Synonyms5-(1,3-benzodioxol-5-yl)-8H-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one;5-(1,3-benzodioxol-5-yl)furo[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(8H)-one;Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(8H)-one, 5-(1,3-benzodioxol-5-yl)-;;
PubChem Id363127
ClassLignans
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyYMGOOHXUOWZQOE-UHFFFAOYSA-N
InChi1S/C20H12O6/c21-20-19-12(7-22-20)3-11-5-16-17(26-9-25-16)6-13(11)18(19)10-1-2-14-15(4-10)24-8-23-14/h1-6H,7-9H2
SMILESO1Cc2c(c(c3c(c2)cc2OCOc2c3)c2cc3OCOc3cc2)C1=O
SMART[H]C1=C([H])C(=C([H])C2=C1OC([H])([H])O2)C1=C2C([H])=C3OC([H])([H])OC3=C([H])C2=C([H])C2=C1C(=O)OC2([H])[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C467766
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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