NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compoundbitucarpin A
NPACT-IdNPACT01468
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 KeyOWVQBBXRFSSWLP-QFQXNSOFSA-N
InChi1S/C26H30O4/c1-15(2)7-8-18-22(27-5)10-9-19-25(18)29-14-21-20-12-17(11-16(3)4)23(28-6)13-24(20)30-26(19)21/h7,9-13,21,26H,8,14H2,1-6H3/t21-,26-/m1/s1
SMILESc1(c(ccc2c1OC[C@H]1[C@@H]2Oc2c1cc(c(c2)OC)C=C(C)C)OC)CC=C(C)C
SMART[H][C@]12COC3=C(C=CC(O[#6])=C3CC=C([#6])[#6])[C@@]1([H])OC1=C2C=C(C=C(/[#6])[#6])C(O[#6])=C1
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C488768
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.