input word = C00016427

Metabolite InformationStructural formula
Name 31F508a2
Antibiotic 31F508a2
Bioxalomycin alpha2
Formula C21H27N3O5
Mw 401.19507099
CAS RN 157207-83-5
C_ID C00016427 ,
InChIKey ZPHGBBFZDUZEDN-IREORTAENA-N
InChICode InChI=1S/C21H27N3O5/c1-8-17(25)13-12(18(26)19(8)27-3)11-7-29-21-10-6-9-14(22(10)2)16(24(11)21)15(13)23-4-5-28-20(9)23/h9-11,14-16,20-21,25-26H,4-7H2,1-3H3/t9-,10-,11-,14+,15+,16+,20+,21+/m0/s1
SMILES c1(c(c(c2c(c1O)[C@@H]1[C@@H]3N4[C@H]2CO[C@@H]4[C@H]2N([C@@H]3[C@@H]([C@@H]3N1CCO3)C2)C)O)OC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. LL-31F508 Ref.
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OrganismStreptomyces sp. LL-31F508
ReferenceBernan,J.Antibiotics,47,(1994),1417