NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound6-O-desmethylsecoantofine
NPACT-IdNPACT01428
IUPAC4-[7-(3,4-dimethoxyphenyl)-1,2,3,5,8,8a-hexahydroindolizin-6-yl]phenol
Synonyms-
PubChem Id21588201
ClassAlkaloids
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyJOMCLUGDXHCAGV-UHFFFAOYSA-N
InChi1S/C22H25NO3/c1-25-21-10-7-16(12-22(21)26-2)19-13-17-4-3-11-23(17)14-20(19)15-5-8-18(24)9-6-15/h5-10,12,17,24H,3-4,11,13-14H2,1-2H3
SMILESO(c1cc(C2=C(CN3C(CCC3)C2)c2ccc(O)cc2)ccc1OC)C
SMART[#6]OC1=C(O[#6])C=C(C=C1)C1=C(CN2CCCC2C1)C1=CC=C(O)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   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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