NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound(S)-tylophorine
NPACT-IdNPACT01388
IUPAC(13aS)-2,3,6,7-tetramethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizine
SynonymsTylophorine;Tylophorin;tylophorine(8ci);Dibenzo[f,2-b]isoquinoline, 9,11,12,13,13a,14-hexahydro-2,3,6,7-tetramethoxy-, (S)-;(+)-Tylophorine;Tylophorine (8CI);2,3,6,7-Tetramethoxyphenanthro(9,10:6,7')indolizidine ;2,6,7-Tetramethoxyphenanthro[9,10:6',7']indolizidine;(13aS)-2,3,6,7-tetramethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizine;9,12,13,13a,14-Hexahydro-2,3,6,7-tetramethoxydibenzo[f,h]pyrrolo[1,2-b]isoquinoline;Dibenzo[f,2-b]isoquinoline, 9,11,12,13,13a,14-hexahydro-2,3,6,7-tetramethoxy-;Dibenzo[f,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,6,7-tetramethoxy-, (13aS)-;(S)-9,11,12,13,13a,14-Hexahydro-2,3,6,7-tetramethoxydibenzo(f,h)pyrrolo(1,2-b)isoquinoline;Dibenzo(f,h)pyrrolo(1,2-b)isoquinoline, 9,11,12,13,13a,14-hexahydro-2,3,6,7-tetramethoxy-, (S)- (9CI)
PubChem Id92114
ClassAlkaloids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsCYC3B |   All | 
Properties Physical   Elemental  Topological
InChi KeySSEUDFYBEOIWGF-AWEZNQCLSA-N
InChi1S/C24H27NO4/c1-26-21-9-16-15-8-14-6-5-7-25(14)13-20(15)19-12-24(29-4)23(28-3)11-18(19)17(16)10-22(21)27-2/h9-12,14H,5-8,13H2,1-4H3/t14-/m0/s1
SMILESO(c1cc2c3C[C@H]4N(CCC4)Cc3c3c(c2cc1OC)cc(OC)c(OC)c3)C
SMART[#6]OC1=C(O[#6])C=C2C(=C1)C1=C(CN3CCC[C@H]3C1)C1=CC(O[#6])=C(O[#6])C=C21
CAS No.482-20-2
Structure
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Cross Refrence in other databases
Super Natural   000482202
CTD   C004218
HIT   C0031
NCI-60 GI50 data   482-20-2
Suppliers AAA Chemistry, ABI Chem, 
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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