Botanical Name Plant's Common Name Plant Family   

   MMP-AC0049 : Ursolic Acid

 
Compound Name  :

Ursolic Acid
 
  Compound Class  : Terpenoids  
  Synonyms  : Ursolic acid; Malol; Prunol; Urson; 77-52-1;

 
  Compound Extracted from  : Ursolic Acid is extracted / reported from 26 Plant(s) of Melghat Flora as below


 
 
Molecular Formula  :

C30H48O3
 
  Molecular Weight  : 456.7  
  InChi Key  :  
  IUPAC  :  
  InChi  :  
  Hydrogen Bond Donor count  : 2  
  Hydrogen Bond Acceptor count  : 3  
  Rotational Bond count  : 1  
  TPSA  : 57.5  
  LogP Value  :

7.3

 
 
Lipinski Rule of Five  :

No
 
  Ghose Filter  : No  
  Veber Filter  : Yes  
  Muegge Filter  :

No

 
 
PubChem CID  :

64945
 
  Drugbank ID  : -  
  Super Natural  : 000077521  
  CTD  : C005466  
  HIT  : C0018  
  NCI-60 GI50 data  :

77-52-1

 
 
Reference(s)  :

https://www.ncbi.nlm.nih.gov/pubmed/27274199


 

Compound_ID Cell Lines Cancer Type IC50 Value EC50 Value ED50 Value GI50 Value References
MMP-AC0049 MCF-7 Breast - - - 178±15 µM 16448187
MMP-AC0049 DLD-1 Colon 9.3±0.3 µM - - - 17156957
MMP-AC0049 HT-29 Colon 4.7±1.5 µM - - - 15694457
MMP-AC0049 A549 Lung 8.9±0.2 µM - - - 15694457
MMP-AC0049 HONE-1 Nasopharyngeal 8.8±1.5 µM - - - 15694457
MMP-AC0049 KB Nasopharyngeal 8.2±2.7 µM - - - 15694457
MMP-AC0049 HT-29 Colon 24h-26 µMol/L - - - 19735099
MMP-AC0049 HT-29 Colon 20 µMol/L - - - 19735099
MMP-AC0049 HT-29 Colon 18 µMol/L - - - 19735099
MMP-AC0049 Hep G2 Liver 15.51 µg/ml - - - 20630652

Compound_ID Target Gene_Name Gene_ID Cancer Cell_lines IC50 Value EC50 Value ED50 Value GI50 Value Remarks References
MMP-AC0049 BAK1 BCL2-antagonist/killer 1 578 Hepatoma Hep G2 - - - - Results suggested that the level of Bak protein was enhanced in a dose-dependent manner induced by UA treatment in R-HepG2 cells 20630652
MMP-AC0049 CASP3 caspase 3, apoptosis-related cysteine peptidase 836 Hepatocellular Carcinoma H22 - - - - Inhibition rate of 52.8% was observed in tumor growth in Ursolic acid treated xenografts. The result of western blot showed that the protein level of Caspase-3 was elevated after treatment with UA 21716649
MMP-AC0049 CASP8 caspase 8, apoptosis-related cysteine peptidase 841 Hepatocellular Carcinoma H22 - - - - Inhibition rate of 52.8% was observed in tumor growth in Ursolic acid treated xenografts. The result of western blot showed that the protein level of Caspase-8 was elevated after treatment with UA 21716649
MMP-AC0049 PTPN1 protein tyrosine phosphatase, non-receptor type 1 5770 Breast adenocarcinoma MCF-7 3.6±0.2 µM - - - PTP1B is overexpressed in human breast cancer, and inhibition of PTP1B delays erbB2-induced mammary tumorigenesis and protects from lung metastasis.Among the isolated compounds, erystgallin A along with isolated compounds was evaluated for their inhibitory effects on protein tyrosine phosphatase-1B (PTP1B), as well as their growth inhibition on MCF7. 19836230