input word = C00036902

Metabolite InformationStructural formula
Name Cimiracemate B
Formula C19H18O7
Mw 358.10525293
CAS RN 478294-17-6
C_ID C00036902 ,
InChIKey AOAGZRJZUKYLHH-QPJJXVBHSA-N
InChICode InChI=1S/C19H18O7/c1-25-18-10-12(2-6-16(18)22)4-7-19(24)26-11-14(20)8-13-3-5-15(21)17(23)9-13/h2-7,9-10,21-23H,8,11H2,1H3/b7-4+
SMILES c1c(c(cc(c1)/C=C/C(=O)OCC(=O)Cc1cc(c(cc1)O)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeCimicifuga racemosa Ref.
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