input word = C00043203

Metabolite InformationStructural formula
Name 4-Hydroxy-(3',7'-dimethyl-1'-oxo-octa-2'-E-6'-dienyl)benzoic acid
Formula C17H20O4
Mw 288.13615913
CAS RN 182916-84-3
C_ID C00043203 ,
InChIKey MPPGIWBJWPIEDY-FMIVXFBMSA-N
InChICode InChI=1S/C17H20O4/c1-11(2)5-4-6-12(3)9-16(19)14-10-13(17(20)21)7-8-15(14)18/h5,7-10,18H,4,6H2,1-3H3,(H,20,21)/b12-9+
SMILES c1cc(cc(c1O)C(=O)/C=C(/CCC=C(C)C)\C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper crassinervium Ref.
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