input word = C00031733

Metabolite InformationStructural formula
Name Descurainolide B
(+)-Descurainolide B
Formula C21H22O8
Mw 402.13146768
CAS RN 848138-65-8
C_ID C00031733 ,
InChIKey KZSJWQVXQDYKAN-WLRTZDKTNA-N
InChICode InChI=1S/C21H22O8/c1-25-15-6-11(7-16(26-2)19(15)22)5-13-10-14(29-21(13)24)12-8-17(27-3)20(23)18(9-12)28-4/h5-9,14,22-23H,10H2,1-4H3/b13-5+/t14-/m0/s1
SMILES COc1cc(/C=C2CC(c3cc(OC)c(O)c(OC)c3)OC2=O)cc(OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeDescurainia sophia Ref.
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