NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundGuttiferone I
NPACT-IdNPACT00639
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 KeyUGOKGDVNXQLGMD-PLMWTVLASA-N
InChi1S/C38H50O6/c1-23(2)11-9-13-26(7)14-16-28-22-29-34(42)32(33(41)27-15-17-30(39)31(40)21-27)36(44)38(35(29)43,20-18-25(5)6)37(28,8)19-10-12-24(3)4/h11-12,14-18,21,26,28-29,39-40,42H,9-10,13,19-20,22H2,1-8H3/b16-14-/t26-,28-,29-,37+,38-/m1/s1
SMILESc1(c(ccc(c1)C(=O)C1=C([C@@H]2C(=O)[C@](C1=O)([C@@]([C@H](/C=C[C@H](C)CCC=C(C)C)C2)(C)CCC=C(C)C)CC=C(C)C)O)O)O
SMART[#6][C@H](CCC=C([#6])[#6])C=C/[C@@H]1C[C@@H]2C(O)=C(C(=O)C3=CC=C(O)C(O)=C3)C(=O)[C@@](CC=C([#6])[#6])(C2=O)[C@@]1([#6])CCC=C([#6])[#6]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C501151
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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