NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound3,5,7,3',4'-pentahydroxyflavonol-3-O-beta-D-galactopyranoside
NPACT-IdNPACT00107
IUPAC-
Synonyms-
PubChem Id-
ClassFlavonoid
In-vitro anticancer activity 2 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyPNYSEFINXPFNNS-AXMVRHARSA-N
InChi1S/C24H26O10/c1-10-3-4-12(5-15(10)27)23-14(11(2)19-16(28)6-13(26)7-17(19)33-23)9-32-24-22(31)21(30)20(29)18(8-25)34-24/h3-7,18,20-22,24-31H,2,8-9H2,1H3/t18-,20-,21+,22-,24-/m0/s1
SMILESc1c(cc(c2c1OC(=C(C2=C)CO[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)CO)c1cc(c(cc1)C)O)O)O
SMART[H][C@]1(OCC2=C(OC3=C(C(O)=CC(O)=C3)C2=C)C2=CC=C([#6])C(O)=C2)O[C@@H](CO)[C@H](O)[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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