NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundTrans-3-(3,4-dimethoxyphenyl)-4-[(E)-3,4-dimethoxystyryl]cyclohex-1-ene
NPACT-IdNPACT00985
IUPAC4-[(E)-2-[(1R,2S)-2-(3,4-dimethoxyphenyl)cyclohex-3-en-1-yl]ethenyl]-1,2-dimethoxybenzene
Synonyms-
PubChem Id9929782
ClassSimple aromatic natural products
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyPHLVYOUORNHOLU-UQAMUYQTSA-N
InChi1S/C24H28O4/c1-25-21-13-10-17(15-23(21)27-3)9-11-18-7-5-6-8-20(18)19-12-14-22(26-2)24(16-19)28-4/h6,8-16,18,20H,5,7H2,1-4H3/b11-9+/t18-,20+/m1/s1
SMILESO(c1cc([C@@H]2[C@H](CCC=C2)/C=C/c2cc(OC)c(OC)cc2)ccc1OC)C
SMART[#6]OC1=C(O[#6])C=C(C=C[C@H]2CCC=C[C@@H]2C2=CC(O[#6])=C(O[#6])C=C2)C=C1
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C522789
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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