NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundArtelasticin
NPACT-IdNPACT00279
IUPAC-
Synonyms2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3,6,8-tris(3-methylbut-2-enyl)chromen-4-one;4H-1-Benzopyran-4-one,4-dihydroxyophenyl)-5,7-dihydroxy-3,6,8-tris(3-methyl-2-butenyl)-
PubChem Id5471311
ClassFlavonoid
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyUEEBMAIKXXZTAU-UHFFFAOYSA-N
InChi1S/C30H34O6/c1-16(2)7-11-21-26(33)22(12-8-17(3)4)30-25(27(21)34)28(35)23(13-9-18(5)6)29(36-30)20-14-10-19(31)15-24(20)32/h7-10,14-15,31-34H,11-13H2,1-6H3
SMILESo1c2c(c(O)c(c(O)c2CC=C(C)C)CC=C(C)C)c(=O)c(c1c1c(O)cc(O)cc1)CC=C(C)C
SMART[H]OC1=C([H])C(O[H])=C(C([H])=C1[H])C1=C(C(=O)C2=C(O[H])C(=C(O[H])C(=C2O1)C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H]
CAS No.182052-13-7
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   182052-13-7
Suppliers ABI Chem, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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