Chebulinic Acid, TRC

CAS: 18942-26-2 Molecular Formula: C41 H32 O27 Molecular Weight (g/mol): 956.68 Synonym: β-D-Glucopyranose, 1,3,6-tris(3,4,5-trihydroxybenzoate), cyclic 2→2:4→1-ester with (2S)-[(3R,4S)-5-carboxy-3,4-dihydro-3,7,8-trihydroxy-2-oxo-2H-1-benzopyran-4-yl]butanedioic acid,7,11-Methanopyrano[4,3,2-kl][2,5,8]benzotrioxacyclotridecin, β-D-glucopyranose deriv.,Chebulinic acid,Eutannin,NSC 69862 IUPAC Name: 2-[(4R,5S,7R,8R,11S,12S,13S,21S)-13,17,18-trihydroxy-2,10,14-trioxo-5,21-bis[(3,4,5-trihydroxybenzoyl)oxy]-7-[(3,4,5-trihydroxybenzoyl)oxymethyl]-3,6,9,15-tetraoxatetracyclo[10.7.1.14,8.016,20]henicosa-1(19),16(20),17-trien-11-yl]acetic acid SMILES: O[C@@H]1[C@H]2[C@H](CC(=O)O)C(=O)O[C@@H]3[C@@H](COC(=O)c4cc(O)c(O)c(O)c4)O[C@@H](OC(=O)c5cc(O)c(O)c(O)c5)[C@H](OC(=O)c6cc(O)c(O)c(OC1=O)c26)[C@H]3OC(=O)c7cc(O)c(O)c(O)c7