input word = C00043145

Metabolite InformationStructural formula
Name 1,6-Dihydroxy-8-methoxy-3,5-dimethylisochroman
Formula C12H16O4
Mw 224.104859
CAS RN 735327-55-6
C_ID C00043145 ,
InChIKey CWGRMEHTZDTNRX-DNVFCDODNA-N
InChICode InChI=1S/C12H16O4/c1-6-4-8-7(2)9(13)5-10(15-3)11(8)12(14)16-6/h5-6,12-14H,4H2,1-3H3/t6-,12+/m1/s1
SMILES [C@@H]1(O[C@@H](c2c(C1)c(c(cc2OC)O)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium expansum Ref.
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