NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound(R)-cryptopleurine
NPACT-IdNPACT01052
IUPAC-
Synonyms9h-phenanthro[9,10-b]quinolizine, 11,12,13,14,14a,15-hexahydro-2,3,6-trimethoxy-,(14ar)-;9H-Phenanthro[9, 11,12,13,14,14a,15-hexahydro-2,3,6-trimethoxy-;(14aR)-2,3,6-trimethoxy-11,12,13,14,14a,15-hexahydro-9H-phenanthro[9,10-b]quinolizine
PubChem Id92765
ClassAlkaloids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyRSHYSOGXGSUUIJ-OAHLLOKOSA-N
InChi1S/C24H27NO3/c1-26-16-7-8-17-19(11-16)21-13-24(28-3)23(27-2)12-20(21)18-10-15-6-4-5-9-25(15)14-22(17)18/h7-8,11-13,15H,4-6,9-10,14H2,1-3H3/t15-/m1/s1
SMILESO(c1cc2c3C[C@@H]4N(CCCC4)Cc3c3c(c2cc1OC)cc(OC)cc3)C
SMART[H]C1=C([H])C2=C(C([H])=C1OC([H])([H])[H])C1=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C([H])=C1C1=C2C([H])([H])[N@@]2C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@]2([H])C1([H])[H]
CAS No.482-22-4
Structure
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Cross Refrence in other databases
Super Natural   000482224
CTD   C007160
HIT   -
NCI-60 GI50 data   482-22-4
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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