NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound(S)-tyloindicine I
NPACT-IdNPACT01055
IUPAC-
SynonymsTyloindicine I;Phenol,4-dimethoxyphenyl)-1,2,3,8a-tetrahydro- 7-indolizinyl]-2,3-dimethoxy-
PubChem Id373661
ClassAlkaloids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyZFICSRNQVIMLDY-KRWDZBQOSA-N
InChi1S/C24H27NO5/c1-27-21-8-7-15(11-22(21)28-2)19-14-25-9-5-6-17(25)13-18(19)16-10-20(26)24(30-4)23(12-16)29-3/h7-8,10-14,17,26H,5-6,9H2,1-4H3/t17-/m0/s1
SMILESO(c1cc(C2=C[C@H]3N(CCC3)C=C2c2cc(OC)c(OC)cc2)cc(O)c1OC)C
SMART[H]OC1=C(OC([H])([H])[H])C(OC([H])([H])[H])=C([H])C(=C1[H])C1=C([H])[C@@]2([H])N(C([H])=C1C1=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C([H])=C1[H])C([H])([H])C([H])([H])C2([H])[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
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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