input word = C00018716

Metabolite InformationStructural formula
Name Tylosin C
3C-O-demethyl-tylosin
Macrocin
Formula C45H75NO17
Mw 901.50349998
CAS RN 11049-15-3
C_ID C00018716 ,
InChIKey UFUYRGNJTFAODM-GMQRHNJNNA-N
InChICode 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+/m0/s1
SMILES [C@H]1([C@H]([C@H]([C@@H]([C@@H](O1)OC[C@@H]1[C@@H](OC(=O)C[C@H]([C@H]([C@@H]([C@H](C[C@@H](C(=O)/C=C\C(=C/1)\C)C)CC=O)O[C@H]1O[C@H]([C@H]([C@@H]([C@@H]1O)N(C)C)O[C@@H]1C[C@@]([C@@H]([C@H](O1)C)O)(C)O)C)C)O)CC)OC)O)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces fradiae Ref.
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