NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compoundcimigenol 3-O-alpha-L-arabinopyranoside
NPACT-IdNPACT01532
IUPAC-
Synonyms-
PubChem Id-
ClassTerpenoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyBTPYUWOBZFGKAI-UHFFFAOYSA-N
InChi1S/C35H56O9/c1-17-14-19-26(30(4,5)40)44-35(43-19)25(17)31(6)12-13-34-16-33(34)11-10-22(42-27-24(38)23(37)18(36)15-41-27)29(2,3)20(33)8-9-21(34)32(31,7)28(35)39/h17-28,36-40H,8-16H2,1-7H3
SMILESC1CC(C(C2C31C1(C(CC2)C2(C(CC1)(C1C4(C2O)OC(CC1C)C(C(C)(O)C)O4)C)C)C3)(C)C)OC1OCC(C(C1O)O)O
SMART[#6]C1CC2OC3(OC2C([#6])([#6])O)C(O)C2([#6])C4CCC5C6(CC46CCC2([#6])C13)CCC(OC1OCC(O)C(O)C1O)C5([#6])[#6]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C516497
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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