NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundIsocephalotaxine
NPACT-IdNPACT01238
IUPAC-
Synonyms-
PubChem Id10245167
ClassAlkaloids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyPQWZXENVZQJUKV-UWBLVGDVSA-N
InChi1S/C18H21NO4/c1-21-17-13(20)9-18-4-2-5-19(18)6-3-11-7-14-15(23-10-22-14)8-12(11)16(17)18/h7-8,13,20H,2-6,9-10H2,1H3/t13?,18-/m0/s1
SMILESOC1C[C@@]23N(CCC2)CCc2c(C3=C1OC)cc1OCOc1c2
SMART[H]O[C@@]1([H])C(OC([H])([H])[H])=C2C3=C([H])C4=C(OC([H])([H])O4)C([H])=C3C([H])([H])C([H])([H])[N@@]3C([H])([H])C([H])([H])C([H])([H])[C@]23C1([H])[H]
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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