Compound Details

 Compound-ID 13956
 Common Name Baccatin III
 InChI InChI=1S/C31H38O11/c1-15-19(34)13-31(38)26(41-27(37)18-10-8-7-9-11-18)24-29(6,20(35)12-21-30(24,14-39-21)42-17(3)33)25(36)23(40-16(2)32)22(15)28(31,4)5/h7-11,19-21,23-24,26,34-35,38H,12-14H2,1-6H3/t19-,20-,21+,23+,24-,26-,29+,30-,31+/m0/s1
 SMILES [H]C34(C(OC(=O)c1ccccc1)C5(O)(CC(O)C(C)=C(C(OC(C)=O)C(=O)C4(C)(C(O)CC2OCC23(OC(C)=O)))C5(C)(C)))
 External Links
 KEGG-COMPOUND-ID C11900
 PUBCHEM-ID 14062
 ChEBI-ID 32898


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