10-decarboxymethyl, 10-hydroxyaclacinomycin A

Properties Image Occurences in reactions MNX_ID MNXM148602 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C40H52NO14 charge 1 mass 770.33823 reference metacycM:CPD-15786 InChIKey OQDCVONZQOVIMP-HERTZNLPSA-O InChI InChI=1S/C40H51NO14/c1-7-40(49)16-27(32-22(39(40)48)13-21-33(36(32)47)35(46)31-20(34(21)45)9-8-10-25(31)43)53-29-14-23(41(5)6)37(18(3)51-29)55-30-15-26(44)38(19(4)52-30)54-28-12-11-24(42)17(2)50-28/h8-10,13,17-19,23,26-30,37-39,43-44,47-49H,7,11-12,14-16H2,1-6H3/p+1/t17-,18-,19-,23-,26-,27-,28-,29-,30-,37+,38+,39?,40+/m0/s1 SMILES CC[C@@]1(O)C[C@H](O[C@H]2C[C@H]([NH+](C)C)[C@H](O[C@H]3C[C@H](O)[C@H](O[C@H]4CCC(=O)[C@H](C)O4)[C@H](C)O3)[C@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C1O

Parent-child relations graph

Deprecated MNXref IDs graph