NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundAculeatin A
NPACT-IdNPACT00213
IUPAC-
Synonyms-
PubChem Id-
ClassPolycyclic aromatic natural products
In-vitro anticancer activtiy 3 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyUAFRNLHPKTXIOW-BFLUCZKCSA-N
InChi1S/C26H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-24-20-23(28)21-26(29-24)19-18-25(30-26)16-14-22(27)15-17-25/h14-17,23-24,28H,2-13,18-21H2,1H3/t23-,24+,26+/m0/s1
SMILES[C@]12(C=CC(=O)C=C1)O[C@]1(CC2)C[C@@H](O)C[C@H](O1)CCCCCCCCCCCCC
SMART[#6]CCCCCCCCCCCC[C@@H]1C[C@H](O)C[C@]2(CC[C@]3(O2)C=CC(=O)C=C3)O1
CAS No.58814-86-1
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C476177
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
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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