Compound Details

 Compound-ID 6185
 Common Name Demethylmacrocin
 Synonyms 2'''-O-Demethyllactenocin
 InChI InChI=1S/C44H73NO17/c1-11-31-28(20-56-42-38(53)37(52)35(50)24(5)58-42)16-21(2)12-13-29(47)22(3)17-27(14-15-46)39(23(4)30(48)18-32(49)60-31)62-43-36(51)34(45(9)10)40(25(6)59-43)61-33-19-44(8,55)41(54)26(7)57-33/h12-13,15-16,22-28,30-31,33-43,48,50-55H,11,14,17-20H2,1-10H3/b13-12+,21-16+/t22-,23+,24-,25-,26+,27+,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40-,41+,42-,43+,44-/m1/s1
 SMILES CCC4OC(=O)CC(O)C(C)C(OC2OC(C)C(OC1CC(C)(O)C(O)C(C)O1)C(C2(O))N(C)C)C(CC=O)CC(C)C(=O)C=CC(C)=CC4(COC3OC(C)C(O)C(O)C3(O))
 External Links
 KEGG-COMPOUND-ID C02400
 PUBCHEM-ID 5434
 ChEBI-ID 15906


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