more general categories    
information about this item 
 
 
03. Biological Effects of Specific Chemicals    
 
 
 
 
 
 
03. Biological Effects of Specific Chemicals  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
05. Industrial Uses    
 
 
 
 
 
 
05. Industrial Uses  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
06. Name of Biological Source of Chemical    
 
 
 
 
 
 
06. Name of Biological Source of Chemical  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  Casearia nigrescens   (4)  
 
 
 
 
07. Part of Biological Source of Chemical    
 
 
 
 
 
 
07. Part of Biological Source of Chemical  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  leaf [PO:0025034]   (351)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  flower [PO:0009046]   (11)  
 
 
 
 
08. Chemical Category    
 
 
 
 
 
 
08. Chemical Category  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
  caseanigrescen A [CHEBI:65588]   (1)  
 
 
 
 
ChEBI Compound Accession Identifier :  
 [CHEBI:65588] 
 
ChEBI Compound Description :  
 A diterpenoid of the clerodane group isolated from the leaves and flowers of Casearia nigrescens. It exhibits cytotoxicity against A2780 human ovarian cancer cell line. 
 
ChEBI Compound Identification Number :  
 65588 
 
ChEBI InChI Value :  
 InChI=1S/C30H42O10/c1-9-11-24(34)39-21-14-22-27(37-19(6)32)40-28(38-20(7)33)30(22)23(15-21)29(8,13-12-16(3)10-2)17(4)25(26(30)35)36-18(5)31/h10,14,17,21,23,25-28,35H,2-3,9,11-13,15H2,1,4-8H3/t17-,21+,23+,25-,26+,27+,28-,29-,30-/m1/s1 
 
ChEBI InChIKey Value :  
 GFJLYOYUCCNCHS-XAOZSVRPSA-N 
 
ChEBI Compound Name :  
 caseanigrescen A 
 
ChEBI SMILES Value :  
 [H][C@@]12C[C@@H](OC(=O)CCC)C=C3[C@H](O[C@@H](OC(C)=O)[C@@]13[C@@H](O)[C@H](OC(C)=O)[C@@H](C)[C@@]2(C)CCC(=C)C=C)OC(C)=O 
 
ChEBI Substance ID :  
 160655792 
 
ChEBI URL :  
 ChEBI:65588  
 
ChemSpider ID :  
 NS 
 
Ontomatica Chemical Accession Key (OnChAKey) :  
 GFJLYOYUCCNCHS_XAOZSVRPSA_N_000_000000 
 
PubChem Compound ID :  
 16109791