input word = C00016104

Metabolite InformationStructural formula
Name RK 1009
Formula C45H64N2O10
Mw 792.45609628
CAS RN 218915-78-7
C_ID C00016104 ,
InChIKey PNAPQJHXPKPELJ-SLNYUAAHNA-N
InChICode InChI=1S/C45H64N2O10/c1-11-13-17-25-37-44(6,7)36(50)29-45(56-10,57-37)33(12-2)42(53)46-27-21-20-23-31(4)41(55-9)32(5)40(52)35(49)24-19-16-14-15-18-22-30(3)39(51)38-34(48)26-28-47(8)43(38)54/h11,13-26,28,32-33,35-37,40-41,48-50,52H,12,27,29H2,1-10H3,(H,46,53)/b13-11+,16-14+,18-15+,21-20+,24-19+,25-17+,30-22+,31-23+/t32-,33+,35+,36+,37-,40-,41+,45-/m1/s1
SMILES c1n(c(=O)c(c(c1)O)C(=O)/C(=C/C=C/C=C/C=C/[C@@H]([C@@H]([C@H]([C@H](/C(=C/C=C/CNC(=O)[C@@H]([C@]1(C[C@@H](C([C@H](O1)/C=C/C=C/C)(C)C)O)OC)CC)/C)OC)C)O)O)/C)C
Start Substs in Alk. Biosynthesis (Prediction) L-His
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. Ref.
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