NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundG-Mangostin
NPACT-IdNPACT00633
IUPAC1,6,7-trihydroxy-3-(hydroxymethyl)-2,8-bis(3-methylbut-2-enyl)xanthen-9-one
Synonyms.gamma.-Mangostin;1,6,7-trihydroxy-3-(hydroxymethyl)-2,8-bis(3-methylbut-2-enyl)xanthen-9-one
PubChem Id5481476
ClassSimple aromatic natural products
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNOS2 |   All | 
Properties Physical   Elemental  Topological
InChi KeyHODIDERFBMZRHC-UHFFFAOYSA-N
InChi1S/C24H26O6/c1-12(2)5-7-15-14(11-25)9-18-21(23(15)28)24(29)20-16(8-6-13(3)4)22(27)17(26)10-19(20)30-18/h5-6,9-10,25-28H,7-8,11H2,1-4H3
SMILESo1c2c(c(O)c(c(c2)CO)CC=C(C)C)c(=O)c2c(CC=C(C)C)c(O)c(O)cc12
SMART[H]OC1=C([H])C2=C(C(=O)C3=C(O2)C([H])=C(C(=C3O[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])O[H])C(=C1O[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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