NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound8,14-epoxide
NPACT-IdNPACT00200
IUPAC-
Synonyms-
PubChem Id-
ClassTerpenoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyUJADOEWLIVXNII-QFCFMDMOSA-N
InChi1S/C20H28O3/c1-12-13-6-7-15(21)19(4)10-5-9-18(2,3)14(19)8-11-20(16(12)22)17(13)23-20/h13-14,17H,1,5-11H2,2-4H3/t13-,14-,17+,19-,20-/m0/s1
SMILESC1CCC([C@H]2[C@]1(C(=O)CC[C@@H]1[C@@H]3[C@](CC2)(C(=O)C1=C)O3)C)(C)C
SMART[#6][C@@]1([#6])CCC[C@@]2([#6])[C@H]1CC[C@@]13O[C@@H]1[C@@H](CCC2=O)C(=C)C3=O
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   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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