input word = C00017887

Metabolite InformationStructural formula
Name Paulomycin E
Formula C29H36N2O16S
Mw 700.17855385
CAS RN 101411-69-2
C_ID C00017887 ,
InChIKey ZIOGVGDMWOZVBR-NSIKDUERNA-N
InChICode InChI=1S/C29H36N2O16S/c1-6-14(31-10-48)27(39)47-22-16(9-43-13(4)33)45-25(28(40)8-15(34)20(30)19(24(28)36)26(37)38)21(35)23(22)46-18-7-17(42-5)29(41,11(2)32)12(3)44-18/h6,12,16-18,21-23,25,35,40-41H,7-9,30H2,1-5H3,(H,37,38)/b14-6-/t12-,16+,17-,18+,21+,22+,23+,25+,28+,29+/m1/s1
SMILES C1(=O)[C@](CC(=O)C(=C1C(=O)O)N)(O)[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O[C@H]1C[C@H]([C@]([C@H](O1)C)(O)C(=O)C)OC)OC(=O)/C(=C/C)/N=C=S)COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces paulus strain No.273 Ref.
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