NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compound(-)-eta-viniferin
NPACT-IdNPACT01395
IUPAC5-[6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
Synonyms(-)-.epsilon.-Viniferin;5-{6-hydroxy-2-(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol;5-(6-Hydroxy-2-(4-hydroxyphenyl)-4-(2-(4-hydroxyphenyl)vinyl)-2,3-dihydro-1-benzofuran-3-yl)-1,3-benzenediol;5-[6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
PubChem Id5315232
ClassSimple aromatic natural products
In-vitro anticancer activity 4 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyFQWLMRXWKZGLFI-DAFODLJHSA-N
InChi1S/C28H22O6/c29-20-7-2-16(3-8-20)1-4-18-11-24(33)15-25-26(18)27(19-12-22(31)14-23(32)13-19)28(34-25)17-5-9-21(30)10-6-17/h1-15,27-33H/b4-1+
SMILESO1C(C(c2c1cc(O)cc2/C=C/c1ccc(O)cc1)c1cc(O)cc(O)c1)c1ccc(O)cc1
SMARTOC1=CC=C(C=CC2=C3C(C(OC3=CC(O)=C2)C2=CC=C(O)C=C2)C2=CC(O)=CC(O)=C2)C=C1
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   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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