NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundTaiwaniaquinol B
NPACT-IdNPACT01339
IUPAC-
Synonyms-
PubChem Id11688549
ClassTerpenoids
In-vitro anticancer activtiy 1 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyPZLPUCMOBKVMOI-UYAOXDASSA-N
InChi1S/C20H28O4/c1-10(2)11-14(21)12-13(16(23)17(11)24-6)20(5)9-7-8-19(3,4)18(20)15(12)22/h10,18,21,23H,7-9H2,1-6H3/t18-,20-/m1/s1
SMILESO=C1[C@H]2[C@](CCCC2(C)C)(c2c1c(O)c(c(OC)c2O)C(C)C)C
SMART[H]OC1=C(C(OC([H])([H])[H])=C(O[H])C2=C1C(=O)[C@@]1([H])[C@]2(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[C@@]1(C([H])([H])[H])C([H])([H])[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   C505702
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
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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