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 CCC1OC(=O)CC(O)C(C)C(OC2OC(C)C(OC3CC(C)(O)C(O)C(C)O3)C(N(C)C)C2O)C(CC=O)CC(C)C(=O)/C=CC(C)=CC1COC1OC(C)C(O)C(O)C1OC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces fradiae Ref.
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