NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundEnglerin A
NPACT-IdNPACT01197
IUPAC-
Synonyms-
PubChem Id46242512
ClassTerpenoids
In-vitro anticancer activtiy 8 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyGACOFEKSDCOVMV-RRYXBOBMSA-N
InChi1S/C26H34O6/c1-16(2)26-14-20(30-22(29)15-27)25(4,32-26)19-12-10-17(3)23(19)24(26)31-21(28)13-11-18-8-6-5-7-9-18/h5-9,11,13,16-17,19-20,23-24,27H,10,12,14-15H2,1-4H3/b13-11+/t17-,19-,20-,23-,24+,25+,26-/m1/s1
SMILESO1[C@]2([C@H]3[C@H]([C@H](OC(=O)/C=C/c4ccccc4)[C@@]1(C[C@H]2OC(=O)CO)C(C)C)[C@@H](CC3)C)C
SMART[H]OC([H])([H])C(=O)O[C@]1([H])C([H])([H])[C@@]2(O[C@@]1(C([H])([H])[H])[C@]1([H])C([H])([H])C([H])([H])[C@@]([H])(C([H])([H])[H])[C@@]1([H])[C@]2([H])OC(=O)C([H])=C(/[H])C1=C([H])C([H])=C([H])C([H])=C1[H])[C@@]([H])(C([H])([H])[H])C([H])([H])[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C534971
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
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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