NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compoundxerophilusin F
NPACT-IdNPACT00429
IUPAC-
Synonyms-
PubChem Id44445779
ClassTerpenoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyMOEKVDYJSLTUSU-PYEDPNNMSA-N
InChi1S/C22H28O7/c1-9-11-8-12(29-10(2)23)13-20-7-5-6-19(3,4)14(20)17(26)22(28,18(20)27)21(13,15(9)24)16(11)25/h11-14,16,18,25,27-28H,1,5-8H2,2-4H3/t11-,12-,13-,14+,16+,18-,20+,21-,22-/m0/s1
SMILESO[C@]12[C@]34[C@H]([C@]5([C@H](C2=O)C(CCC5)(C)C)[C@@H]1O)[C@@H](OC(=O)C)C[C@H]([C@H]3O)C(=C)C4=O
SMART[#6]C(=O)O[C@H]1C[C@@H]2[C@@H](O)[C@]3([C@@H]1[C@]14CCCC([#6])([#6])[C@H]1C(=O)[C@]3(O)[C@H]4O)C(=O)C2=C
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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