input word = C00018366

Metabolite InformationStructural formula
Name Antibiotic X 14667A
Formula C44H69NO12
Mw 803.48197668
CAS RN 75761-62-5
C_ID C00018366 ,
InChIKey BMTPRPLWWXOKLI-UHFFFAOYNA-N
InChICode InChI=1S/C44H69NO12/c1-25-21-27(3)44(50,24-52-40(49)45-20-16-31-13-11-10-12-14-31)56-35(25)33-22-26(2)38(53-33)42(8)17-15-34(54-42)41(7)18-19-43(57-41)23-32(46)28(4)37(55-43)29(5)36(51-9)30(6)39(47)48/h10-14,25-30,32-38,46,50H,15-24H2,1-9H3,(H,45,49)(H,47,48)/t25-,26-,27+,28-,29+,30-,32-,33-,34+,35-,36-,37-,38-,41-,42-,43+,44-/m1/s1
SMILES COC(C(C)C(=O)O)C(C)C1OC2(CCC(C)(C3CCC(C)(C4OC(C5OC(O)(COC(=O)NCCc6ccccc6)C(C)CC5C)CC4C)O3)O2)CC(O)C1C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces cinnamonensis subsp. urethanofaciens Ref.
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