NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundChamaecypanone C
NPACT-IdNPACT00412
IUPAC3-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Synonyms-
PubChem Id16067359
ClassUnknown
In-vitro anticancer activtiy 7 cancer cell lines
In-Vivo anticancer activtiy No
TargetsCASP3 | CASP8 | CCNB1 | CDC25C | FOXM1 | PARP1 | TUBG1 |   All | 
Properties Physical   Elemental  Topological
InChi KeyJFXFDPCYNPIOGQ-ROURDUCTSA-N
InChi1S/C27H26O5/c1-14(2)19-12-21-23-24(30)20(15-4-8-17(28)9-5-15)13-27(23,16-6-10-18(29)11-7-16)22(19)25(31)26(21,3)32/h4-14,21-23,28-29,32H,1-3H3/t21-,22-,23-,26+,27+/m0/s1
SMILESO[C@@]1([C@@H]2[C@@H]3[C@]([C@@H](C(=C2)C(C)C)C1=O)(C=C(C3=O)c1ccc(O)cc1)c1ccc(O)cc1)C
SMART[#6][C@@H]([#6])C1=C[C@H]2[C@H]3C(=O)C(=C[C@]3([C@@H]1C(=O)[C@]2([#6])O)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C539295
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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