NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundErysenegalensein E
NPACT-IdNPACT01474
IUPAC-
Synonyms-
PubChem Id-
ClassFlavonoid
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeySHCCDOFTQHBUCP-OAQYLSRUSA-N
InChi1S/C26H28O5/c1-14(2)6-11-18-23(28)19(12-21(27)15(3)4)26-22(24(18)29)25(30)20(13-31-26)17-9-7-16(5)8-10-17/h6-10,13,21,27-29H,3,11-12H2,1-2,4-5H3/t21-/m1/s1
SMILESc1(c(c(c(c2c1occ(c2=O)c1ccc(cc1)C)O)CC=C(C)C)O)C[C@H](C(=C)C)O
SMART[H]OC1=C(CC=C(/[#6])[#6])C(O)=C(C[C@@H](O)C([#6])=C)C2=C1C(=O)C(=CO2)C1=CC=C([#6])C=C1
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
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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