NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundBenzoic acid alpha-L-arabinopyranosyl(1->6)-beta-D-glucopyranoside
NPACT-IdNPACT00316
IUPAC[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] benzoate
Synonyms-
PubChem Id-
ClassUnknown
In-vitro anticancer activtiy 2 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyWGYAFONFGRTQCH-FCESTNIZSA-N
InChi1S/C17H22O11/c18-6-8-9(19)11(21)15(25-8)27-17-13(23)10(20)12(22)16(28-17)26-14(24)7-4-2-1-3-5-7/h1-5,8-13,15-23H,6H2/t8-,9-,10-,11+,12-,13+,15-,16-,17+/m0/s1
SMILESc1cccc(c1)C(=O)O[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)O[C@@H]1O[C@H]([C@@H]([C@H]1O)O)CO
SMART[H][C@@]1(O[C@@H]2O[C@]([H])(OC(=O)C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O
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   Yes
Veber filter   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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