NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound3'-demethoxy-6-O-demethylisoguaicin
NPACT-IdNPACT01463
IUPAC-
Synonyms-
PubChem Id-
ClassLignans
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyKVQNZHBGJXIMPI-LSSOAPJISA-N
InChi1S/C18H20O3/c1-10-7-13-8-16(20)17(21)9-15(13)18(11(10)2)12-3-5-14(19)6-4-12/h3-6,8-11,18-21H,7H2,1-2H3/t10-,11-,18?/m1/s1
SMILESc1cc(ccc1C1[C@@H]([C@@H](Cc2c1cc(c(c2)O)O)C)C)O
SMART[#6][C@@H]1CC2=C(C=C(O)C(O)=C2)C([C@@H]1[#6])C1=CC=C(O)C=C1
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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