NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound1,2-Di-O-(9Z,12Z,15Z-octadecatrienoyl)-3-O-(6-p-hydroxy-phenyl-propionamido-6-deoxy-alpha-D-glucosyl)-glycerol
NPACT-IdNPACT01545
IUPAC-
Synonyms-
PubChem Id-
ClassAliphatic natural products
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyMXHQMADMQRFPEW-YTWBPVBXSA-N
InChi1S/C54H83NO11/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-49(58)63-42-46(65-50(59)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)43-64-54-53(62)52(61)51(60)47(66-54)41-55-48(57)40-37-44-35-38-45(56)39-36-44/h5-8,11-14,17-20,35-36,38-39,46-47,51-54,56,6
SMILESC(C(COC1OC(C(C(C1O)O)O)CNC(=O)CCc1ccc(cc1)O)OC(=O)CCCCCCC/C=CC/C=CC/C=CCC)OC(=O)CCCCCCC/C=CC/C=CC/C=CCC
SMART[#6]CC=C/CC=C/CC=C/CCCCCCCC(=O)OCC(COC1OC(CNC(=O)CCC2=CC=C(O)C=C2)C(O)C(O)C1O)OC(=O)CCCCCCCC=C/CC=C/CC=C/C[#6]
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   No
Ghose filter   No
Veber filter   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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