NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundGarcidepsidone C
NPACT-IdNPACT00595
IUPAC-
Synonyms-
PubChem Id-
ClassSimple aromatic natural products
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyBGQDQJFUOISXDC-CAOOACKPSA-N
InChi1S/C29H36O8/c1-16(2)11-12-19-25(32)21(31)15-23-27(19)37-28(34)24-22(36-23)14-20(30)18(26(24)33)10-6-8-17(3)9-7-13-29(4,5)35/h8,11,14-15,30-33,35H,6-7,9-10,12-13H2,1-5H3/b17-8+
SMILESc1(c(c(cc2c1C(=O)Oc1c(c(c(cc1O2)O)O)CC=C(C)C)O)CC/C=C(/CCCC(C)(C)O)C)O
SMART[H]C1=C(O)C(CCC=C(/[#6])CCC[C@@]([#6])([#6])O)=C(O)C2=C1OC1=C(OC2=O)C(CC=C([#6])[#6])=C(O)C(O)=C1
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   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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