input word = C00042855

Metabolite InformationStructural formula
Name Pierotin B
Formula C22H18O7
Mw 394.10525293
CAS RN 850659-40-4
C_ID C00042855 ,
InChIKey YEVIEPVZESGCLZ-UHFFFAOYSA-N
InChICode InChI=1S/C22H18O7/c1-28-19-10-17(27)21(14(24)7-4-11-2-5-12(23)6-3-11)22-20(19)13-8-15(25)16(26)9-18(13)29-22/h2-3,5-6,8-10,23,25-27H,4,7H2,1H3
SMILES c12c(c3c(o1)cc(c(c3)O)O)c(cc(c2C(=O)CCc1ccc(cc1)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaePieris japonica Ref.
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