NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundGarcidepsidone A
NPACT-IdNPACT00593
IUPAC2,3,7,9-tetrahydroxy-4,8,10-tris(3-methylbut-2-enyl)benzo[b][1,4]benzodioxepin-6-one
Synonyms-
PubChem Id10504902
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 KeyQNAGATQUKNWGFB-UHFFFAOYSA-N
InChi1S/C28H32O7/c1-14(2)7-10-17-23(30)18(11-8-15(3)4)27-22(25(17)32)28(33)35-26-19(12-9-16(5)6)24(31)20(29)13-21(26)34-27/h7-9,13,29-32H,10-12H2,1-6H3
SMILESO1c2c(c(O)c(c(O)c2C(=O)Oc2c1cc(O)c(O)c2CC=C(C)C)CC=C(C)C)CC=C(C)C
SMART[H]OC1=C([H])C2=C(OC(=O)C3=C(O[H])C(=C(O[H])C(=C3O2)C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C(=C1O[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H]
CAS No.-
Structure
Download

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

 






Copyright © 2012. Subhash M. Agagrwal. All Rights Reserved.