NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundTaiwaniaquinol D
NPACT-IdNPACT01517
IUPAC5,8-dihydroxy-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-3,4-dihydro-2H-fluorene-9-carbaldehyde
Synonyms-
PubChem Id11175350
ClassTerpenoids
In-vitro anticancer activtiy 1 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyJILXWJZSXVLMCM-UHFFFAOYSA-N
InChi1S/C21H28O4/c1-11(2)13-16(23)14-12(10-22)19-20(3,4)8-7-9-21(19,5)15(14)17(24)18(13)25-6/h10-11,23-24H,7-9H2,1-6H3
SMILESOc1c2C3(C(=C(c2c(O)c(c1OC)C(C)C)C=O)C(CCC3)(C)C)C
SMART[#6]OC1=C(O)C2=C(C(C=O)=C3C2([#6])CCCC3([#6])[#6])C(O)=C1C([#6])[#6]
CAS No.-
Structure
Download

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

 






Copyright © 2012. Subhash M. Agagrwal. All Rights Reserved.