NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound5-methoxypsoralen
NPACT-IdNPACT00178
IUPAC4-methoxyfuro[3,2-g]chromen-7-one
SynonymsBergapten ;5-Methoxypsoralen ;bergaptene;Heraclin;Majudin;BERGAPTAN;Psoraderm;5-Methoxyfuranocoumarin;O-Methylbergaptol
PubChem Id2355
ClassBenzopyranoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsEGF |   All | 
Properties Physical   Elemental  Topological
InChi KeyBGEBZHIAGXMEMV-UHFFFAOYSA-N
InChi1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3
SMILESo1c2c(c(OC)c3c(oc(=O)cc3)c2)cc1
SMART[H]C1=C([H])C2=C(O1)C([H])=C1OC(=O)C([H])=C([H])C1=C2OC([H])([H])[H]
CAS No.484-20-8
Structure
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Cross Refrence in other databases
Super Natural   000484208
CTD   C022909
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, AKos Consulting & Solutions, Amadis Chemical, Ambinter, ASINEX, ChemFrog, ChemMol, Hangzhou APIChem Technology, IS Chemical Technology, MolPort, MP Biomedicals, R&D Chemicals, Sigma-Aldrich, TCI (Tokyo Chemical Industry), TimTec, Vitas-M Laboratory, ZINC, 
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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