NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compound3-o-(trans-p-coumaroyl)-maslinic acid
NPACT-IdNPACT01450
IUPAC-
Synonyms-
PubChem Id-
ClassTerpenoids
In-vitro anticancer activity 6 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyFJOUAWQHGCMRGH-PDNLQZMISA-N
InChi1S/C40H62O6/c1-35(2)16-18-40(34(45)46)19-17-38(6)26(28(40)22-35)10-12-32-37(5)23-30(42)27(36(3,4)31(37)14-15-39(32,38)7)21-25-20-24(8-11-29(25)41)9-13-33(43)44/h9-10,13,24-25,27-32,41-42H,8,11-12,14-23H2,1-7H3,(H,43,44)(H,45,46)/b13-9+/t24?,25?,27?,28-,29
SMILESC1C(C(C(C2C1(C1C(CC2)(C2(C(=CC1)[C@H]1C(CC2)(C(=O)O)CCC(C1)(C)C)C)C)C)(C)C)CC1C(CCC(C1)/C=C/C(=O)O)O)O
SMART[H]C(=C([H])C(O)=O)C1CCC(O)C(CC2C(O)CC3([#6])C(CCC4([#6])C3([H])CC=C3[C@]5([H])CC([#6])([#6])CCC5(CCC43[#6])C(O)=O)C2([#6])[#6])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   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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