input word = C00018437

Metabolite InformationStructural formula
Name 2'''-O-Demethylmacrocin
Antibiotic YO 7625
DOMM
Demethylmacrocin
Formula C44H73NO17
Mw 887.48784992
CAS RN 79404-98-1
C_ID C00018437 ,
InChIKey ALZAOGATQMXJKX-PLDGPZNRNA-N
InChICode 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-/m0/s1
SMILES [C@H]1([C@H](/C=C(/C=C\C(=O)[C@H](C[C@@H]([C@@H]([C@@H]([C@@H](CC(=O)O1)O)C)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)CC=O)C)\C)CO[C@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces fradiae GS16 (ATCC 31669) Ref.
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