input word = C00057535

Metabolite InformationStructural formula
Name 4-Nerolidylcatechol
Formula C21H30O2
Mw 314.2245802
CAS RN 74683-11-7
C_ID C00057535
InChIKey ZBZZDHDWRSFLAY-GZTJUZNOSA-N
InChICode InChI=1S/C21H30O2/c1-6-21(5,18-12-13-19(22)20(23)15-18)14-8-11-17(4)10-7-9-16(2)3/h6,9,11-13,15,22-23H,1,7-8,10,14H2,2-5H3/b17-11+
SMILES C=CC(C)(CC/C=C(C)CCC=C(C)C)c1ccc(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper peltatum Ref.
PlantaePiperaceaePiper umbellatum Ref.
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OrganismPiper umbellatum
ReferenceGustafson, K.R. et al., JOC, 1992, 57, 2809-2811 (isol, uv, ir, pmr, cmr)