input word = C00039500

Metabolite InformationStructural formula
Name Julichrome Q3.5
Formula C36H30O13
Mw 670.16864105
CAS RN 31498-89-2
C_ID C00039500 ,
InChIKey JJRMFXHFOOMZIG-KGYGDXFINA-N
InChICode InChI=1S/C36H30O13/c1-12-10-20(39)25-26(22(12)13(2)37)29(43)18-8-6-16(27(41)23(18)30(25)44)17-7-9-19-24(28(17)42)33(46)35-21(40)11-34(5,47)31(14(3)48-15(4)38)36(35,49-35)32(19)45/h6-10,14,31,33,39,41-42,46-47H,11H2,1-5H3/t14-,31+,33-,34+,35-,36+/m1/s1
SMILES c12c(C(=O)c3c(C1=O)c(c(cc3O)C)C(=O)C)c(c(cc2)c1ccc2c([C@H]([C@@]34[C@@](C2=O)([C@H]([C@@](CC3=O)(C)O)[C@@H](C)OC(=O)C)O4)O)c1O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. isolate GW6225 Ref.
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