NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a a
CompoundUvaretin
NPACT-IdNPACT01365
IUPAC-
Synonyms1-(2,4-Dihydroxy-3-(2-hydroxybenzyl)-6-methoxyphenyl)-3-phenyl-1-propanone;1-(2,4-Dihydroxy-3-((2-hydroxyphenyl)methyl)-6-methoxyphenyl)-3-phenyl-1-propanone;1-[2,4-dihydroxy-3-[(2-hydroxyphenyl)methyl]-6-methoxyphenyl]-3-phenylpropan-1-one;
PubChem Id73447
ClassFlavonoid
In-vitro anticancer activtiy 1 cancer cell lines
In-Vivo anticancer activtiy No
TargetsCASP3 |   All | 
Properties Physical   Elemental  Topological
InChi KeyLQHGGFQNRNEFIG-UHFFFAOYSA-N
InChi1S/C23H22O5/c1-28-21-14-20(26)17(13-16-9-5-6-10-18(16)24)23(27)22(21)19(25)12-11-15-7-3-2-4-8-15/h2-10,14,24,26-27H,11-13H2,1H3
SMILESO(c1c(c(O)c(Cc2c(O)cccc2)c(O)c1)C(=O)CCc1ccccc1)C
SMART[H]OC1=C([H])C([H])=C([H])C([H])=C1C([H])([H])C1=C(O[H])C(C(=O)C([H])([H])C([H])([H])C2=C([H])C([H])=C([H])C([H])=C2[H])=C(OC([H])([H])[H])C([H])=C1O[H]
CAS No.58449-06-2
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C012092
HIT   -
NCI-60 GI50 data   58449-06-2
Suppliers AAA Chemistry, ABI Chem, Ambinter, Kingston Chemistry, MolPort, ZINC, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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