input word = C00031666

Metabolite InformationStructural formula
Name Chaetoquadrin C
CQ 3
Formula C20H24O6
Mw 360.1572885
CAS RN 457616-38-5
C_ID C00031666 ,
InChIKey MHQCFVVDBXCFCK-UOVWRPEFNA-N
InChICode InChI=1S/C20H24O6/c1-10-5-14-16(23-4)8-17-18(15(22)7-11(2)24-17)19(14)26-20(10)9-13(21)6-12(3)25-20/h7-8,10,12-13,21H,5-6,9H2,1-4H3/t10-,12-,13-,20+/m0/s1
SMILES c12c(cc(c3c1O[C@@]1([C@H](C3)C)C[C@H](C[C@@H](O1)C)O)OC)oc(cc2=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeChaetomium quadrangulatum Ref.
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