input word = C00002485

Metabolite InformationStructural formula
Name Nodakenetin
Formula C14H14O4
Mw 246.08920894
CAS RN 495-32-9
C_ID C00002485 ,
InChIKey FWYSBEAFFPBAQU-STGVRZAANA-N
InChICode InChI=1S/C14H14O4/c1-14(2,16)12-6-9-5-8-3-4-13(15)18-10(8)7-11(9)17-12/h3-5,7,12,16H,6H2,1-2H3/t12-/m1/s1
SMILES c12c(cc3c(c1)ccc(=O)o3)O[C@H](C2)C(C)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica decursiva Ref.
PlantaeApiaceaeAngelica gigas Ref.
PlantaeApiaceaeAngelica pubescens f.biserrata Ref.
PlantaeApiaceaeHeracleum sprengelianum Ref.
PlantaeApiaceaeNotopterygium forbesii Ref.
PlantaeApiaceaeNotopterygium incisum Ref.
PlantaeApiaceaePeucedanum decursivum Ref.
PlantaeApiaceaePeucedanum praeruptorum Ref.
PlantaeGoodeniaceaeScaevola frutescens Ref.
PlantaeRutaceaeChloroxylon spp. Ref.
PlantaeRutaceaePtelea spp. Ref.
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OrganismPtelea spp.
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter35