input word = C00038754

Metabolite InformationStructural formula
Name Chlorocyclinone C
Formula C26H21ClO10
Mw 528.0823246
CAS RN 950676-22-9
C_ID C00038754 ,
InChIKey LMNHPKWXMIGBEL-UHFFFAOYNA-N
InChICode InChI=1S/C26H21ClO10/c1-9-5-11-6-14(29)19-20(17(11)25(35-3)21(9)27)22(31)12-7-13(26(34)36-4)16(10(2)37-15(30)8-28)23(32)18(12)24(19)33/h5-7,10,28-29,32H,8H2,1-4H3/t10-/m0/s1
SMILES COC(=O)c1cc2c(c(O)c1C(C)OC(=O)CO)C(=O)c1c(O)cc3cc(C)c(Cl)c(OC)c3c1C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp.DSM17045 Ref.
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