NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundDalrubone
NPACT-IdNPACT00480
IUPAC(6E)-6-chromen-2-ylidene-5-methoxy-2,2,4-trimethylcyclohex-4-ene-1,3-dione
Synonyms-
PubChem Id10380681
ClassFlavonoid
In-vitro anticancer activity 5 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyQYSRVJCZEMMWKO-CCEZHUSRSA-N
InChi1S/C19H18O4/c1-11-16(22-4)15(18(21)19(2,3)17(11)20)14-10-9-12-7-5-6-8-13(12)23-14/h5-10H,1-4H3/b15-14+
SMILESO(C1=C(C(=O)C(C(=O)/C/1=C1/Oc2c(C=C1)cccc2)(C)C)C)C
SMART[H]C1=C([H])C([H])=C2C([H])=C([H])C(OC2=C1[H])=C1C(OC([H])([H])[H])=C(C(=O)[C@](C1=O)(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H]
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   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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