NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundAgathisflavone
NPACT-IdNPACT00222
IUPAC-
Synonyms-
PubChem Id5281599
ClassFlavonoid
In-vitro anticancer activity 5 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyBACLASYRJRZXMY-UHFFFAOYSA-N
InChi1S/C30H18O10/c31-15-5-1-13(2-6-15)22-11-20(36)26-24(39-22)12-21(37)27(29(26)38)28-18(34)9-17(33)25-19(35)10-23(40-30(25)28)14-3-7-16(32)8-4-14/h1-12,31-34,37-38H
SMILESo1c2c(c3c(O)c4c(oc(cc4=O)c4ccc(O)cc4)cc3O)c(O)cc(O)c2c(=O)cc1c1ccc(O)cc1
SMART[H]OC1=C([H])C([H])=C(C([H])=C1[H])C1=C([H])C(=O)C2=C(O1)C([H])=C(O[H])C(=C2O[H])C1=C(O[H])C([H])=C(O[H])C2=C1OC(=C([H])C2=O)C1=C([H])C([H])=C(O[H])C([H])=C1[H]
CAS No.28441-98-7
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, Ambinter, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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