NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compound5,7,4'-trihydroxy-6-methoxyhomoisoflavanone
NPACT-IdNPACT01391
IUPAC(3R)-5,7-dihydroxy-3-[(4-hydroxyphenyl)methyl]-6-methoxy-2,3-dihydrochromen-4-one
Synonyms5,7-dihydroxy-3-(4-hydroxybenzyl)-6-methoxy-2,3-dihydro-4H-chromen-4-one;(3R)-5,7-dihydroxy-3-[(4-hydroxyphenyl)methyl]-6-methoxy-2,3-dihydrochromen-4-one;4H-1-benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-3-[(4-hydroxyphenyl)methyl]-6-methoxy-
PubChem Id638288
ClassFlavonoid
In-vitro anticancer activity 5 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyCGCVUMRAPMFWDT-SNVBAGLBSA-N
InChi1S/C17H16O6/c1-22-17-12(19)7-13-14(16(17)21)15(20)10(8-23-13)6-9-2-4-11(18)5-3-9/h2-5,7,10,18-19,21H,6,8H2,1H3/t10-/m1/s1
SMILESO1C[C@@H](Cc2ccc(O)cc2)C(=O)c2c1cc(O)c(OC)c2O
SMART[#6]OC1=C(O)C=C2OC[C@@H](CC3=CC=C(O)C=C3)C(=O)C2=C1O
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
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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