NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundFerruginin A
NPACT-IdNPACT01206
IUPAC-
Synonymstrans-gamma-Ferruginin A;.gamma.-hydroxy Ferruginin A;FERRUGININ A, TRANS-GAMMA;4,5,10-trihydroxy-1-[(E)-4-hydroxy-3-methylbut-2-enyl]-7-methyl-1,6-bis(3-methylbut-2-enyl)anthracen-2-one;
PubChem Id10253728
ClassTerpenoids
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyCAMZGZXMXKJMGF-UHFFFAOYSA-N
InChi1S/C30H36O4/c1-17(2)8-9-22-20(7)14-21-15-23-27(29(34)26(21)28(22)33)24(31)16-25(32)30(23,12-10-18(3)4)13-11-19(5)6/h8,10-11,14-16,31,33-34H,9,12-13H2,1-7H3
SMILESO=C1C(c2c(c(O)c3c(c2)cc(c(c3O)CC=C(C)C)C)C(=C1)O)(CC=C(C)C)CC=C(C)C
SMART[#6]C([#6])=CCC1=C(O)C2=C(O)C3=C(C=C2C=C1[#6])C(CC=C([#6])[#6])(CC=C([#6])[#6])C(=O)C=C3O
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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