input word = C00057338

Metabolite InformationStructural formula
Name Piperolein B
Formula C21H29NO3
Mw 343.2147438
CAS RN 30505-89-6
C_ID C00057338
InChIKey FAXXHNWVMKTOFF-UXBLZVDNSA-N
InChICode InChI=1S/C21H29NO3/c23-21(22-14-8-5-9-15-22)11-7-4-2-1-3-6-10-18-12-13-19-20(16-18)25-17-24-19/h6,10,12-13,16H,1-5,7-9,11,14-15,17H2/b10-6+
SMILES O=C(CCCCCC/C=C/c1ccc2c(c1)OCO2)N1CCCCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper nigrum Ref.
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