Botanical Name Plant's Common Name Plant Family   

   MMP-AC0048 : Betulinic acid

 
Compound Name  :

Betulinic acid
 
  Compound Class  : Terpenoids  
  Synonyms  : betulinic acid; 472-15-1; Betulic acid; Mairin; Lupatic Acid;

 
  Compound Extracted from  : Betulinic acid is extracted / reported from 17 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  : 2  
  TPSA  : 57.5  
  LogP Value  :

8.2

 
 
Lipinski Rule of Five  :

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

No

 
 
PubChem CID  :

64971
 
  Drugbank ID  : DB12480  
  Super Natural  : 000472151  
  CTD  : C002070  
  HIT  : -  
  NCI-60 GI50 data  :

472-15-1

 
 
Reference(s)  :

https://www.ncbi.nlm.nih.gov/pubmed/24463094


 

Compound_ID Cell Lines Cancer Type IC50 Value EC50 Value ED50 Value GI50 Value References
MMP-AC0048 MCF-7 Breast - - - 181±20 µM 16448187
MMP-AC0048 DLD-1 Colon 15.0±0.3 µM - - - 16787747
MMP-AC0048 A549 Lung 10.3±0.4 µM - - - 16787747
MMP-AC0048 B16-F1 Skin 16.1±0.5 µM - - - 16787747
MMP-AC0048 LOX-IMVI Colon - - 9.2±0.3 µM - 14735446
MMP-AC0048 K-562 Haematopoietic and Lymphoid tissue - - 13±1.3 µM - 14735446
MMP-AC0048 A549 Lung - - 14±2.2 µM - 14735446
MMP-AC0048 PC-3 Prostate - - 15±0.5 µM - 14735446
MMP-AC0048 B16(F10) Skin - - 14±0.2 µM - 14735446
MMP-AC0048 SK-MEL-2 Skin - - 7.2±0.6 µM - 14735446

Compound_ID Target Gene_Name Gene_ID Cancer Cell_lines IC50 Value EC50 Value ED50 Value GI50 Value Remarks References
MMP-AC0048 BAX BCL2-associated X protein 581 Lung adenocarcinoma A549 - - - - A significant increase in bax gene expression, was observed when A549 cells were incubated with different concentration of BA. 16964520
MMP-AC0048 BAX BCL2-associated X protein 581 Colon Cancer HT-29 - - - - A significant increase in bax gene expression, was observed when HT-29 cells were incubated with different concentration of BA. 16964520
MMP-AC0048 BCL2 B-cell CLL/lymphoma 2 596 Breast Carcinoma T-47D - - - - Tumor cell lines showed a decrease of bcl-2 expression when incubated with 1 µM or 5 µM betulinic acid for 24 h. 16964520
MMP-AC0048 BCL2 B-cell CLL/lymphoma 2 596 Medulloblastoma TE-671 - - - - Tumor cell lines showed a decrease of bcl-2 expression when incubated with 1 µM or 5 µM betulinic acid for 24 h. 16964520
MMP-AC0048 CCND1 cyclin D1 595 Breast Carcinoma T-47D - - - - Betulinic acid induces dose-dependent changes in expression of cyclin D1 gene 16964520
MMP-AC0048 CCND1 cyclin D1 595 Thyroid carcinoma FTC238 - - - - Betulinic acid induces dose-dependent changes in expression of cyclin D1 gene 16964520