Compound Details

 Compound-ID 5209
 Common Name Macrocin
 InChI InChI=1S/C45H75NO17/c1-12-32-29(21-57-44-41(56-11)38(53)36(51)25(5)59-44)17-22(2)13-14-30(48)23(3)18-28(15-16-47)39(24(4)31(49)19-33(50)61-32)63-43-37(52)35(46(9)10)40(26(6)60-43)62-34-20-45(8,55)42(54)27(7)58-34/h13-14,16-17,23-29,31-32,34-44,49,51-55H,12,15,18-21H2,1-11H3/b14-13+,22-17+/t23-,24+,25-,26-,27+,28+,29-,31-,32-,34+,35-,36-,37-,38-,39-,40-,41-,42+,43+,44-,45-/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(OC))
 External Links
 KEGG-COMPOUND-ID C00744
 PUBCHEM-ID 4006
 ChEBI-ID 17371


View all entries for compound: Macrocin




© HITS gGmbH