input word = C00031668

Metabolite InformationStructural formula
Name Chaetoquadrin E
(+)-Chaetoquadrin E
Formula C17H22O6
Mw 322.14163844
CAS RN 455955-53-0
C_ID C00031668 ,
InChIKey KGNHXSDZEFTYDT-FOONRALVNA-N
InChICode InChI=1S/C17H22O6/c1-9(18)6-11(19)4-5-12-14(22-3)8-15-16(17(12)21)13(20)7-10(2)23-15/h7-9,11,18-19,21H,4-6H2,1-3H3/t9-,11-/m0/s1
SMILES COc1cc2oc(C)cc(=O)c2c(O)c1CC[C@H](O)C[C@H](C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeChaetomium quadrangulatum Ref.
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