NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compoundalpha-lapachone
NPACT-IdNPACT01122
IUPAC-
Synonyms2H-Naphtho[2,3-b]pyran-5,10-dione, 3,4-dihydro-2,2-dimethyl-;Pyranonaphthoquinone derivative, 51;2,2-dimethyl-3,4-dihydrobenzo[g]chromene-5,10-dione;2H-Naphtho[2,10-dione, 3,4-dihydro-2,2-dimethyl-;
PubChem Id72732
ClassPolycyclic aromatic natural products
In-vitro anticancer activtiy 8 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyPJWHOPKRRBUSDH-UHFFFAOYSA-N
InChi1S/C15H14O3/c1-15(2)8-7-11-12(16)9-5-3-4-6-10(9)13(17)14(11)18-15/h3-6H,7-8H2,1-2H3
SMILESO1C(CCC2=C1C(=O)c1c(C2=O)cccc1)(C)C
SMART[H]C1=C([H])C([H])=C2C(=O)C3=C(O[C@](C([H])([H])[H])(C([H])([H])[H])C([H])([H])C3([H])[H])C(=O)C2=C1[H]
CAS No.4707-33-9
Structure
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Cross Refrence in other databases
Super Natural   004707339
CTD   C415043
HIT   -
NCI-60 GI50 data   -
Suppliers AAA Chemistry, 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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