input word = C00017205

Metabolite InformationStructural formula
Name Enopeptin A
Depsipeptide A
Formula C47H57N7O11
Mw 895.41160572
CAS RN 139601-96-0
C_ID C00017205 ,
InChIKey ODKIYTBYJKALOK-SZMANEMWNA-N
InChICode InChI=1S/C47H57N7O11/c1-29-25-36-47(64)65-28-34(45(62)53-24-16-19-35(53)46(63)52(4)31(3)42(59)48-30(2)44(61)54(36)27-29)50-43(60)33(26-32-17-12-11-13-18-32)49-39(57)20-14-9-7-5-6-8-10-15-21-40(58)51-41-37(55)22-23-38(41)56/h5-15,17-18,20-21,29-31,33-36,55H,16,19,22-28H2,1-4H3,(H,48,59)(H,49,57)(H,50,60)(H,51,58)/b6-5+,9-7+,10-8+,20-14+,21-15+/t29-,30-,31+,33+,34+,35-,36-/m1/s1
SMILES N1[C@@H](C(=O)N2[C@@H](C(=O)OC[C@@H](C(=O)N3[C@@H](C(=O)N([C@H](C1=O)C)C)CCC3)NC(=O)[C@@H](NC(=O)/C=C/C=C/C=C/C=C/C=C/C(=O)NC1=C(CCC1=O)O)Cc1ccccc1)C[C@H](C2)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. RK-1051 Ref.
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