input word = C00007671

Metabolite InformationStructural formula
Name N-(E-4-coumaroyl)-aspartate
Formula C13H13NO6
Mw 279.07428716
CAS RN
C_ID C00007671 ,
InChIKey FKBRNPNAUOXZMQ-ZZXKWVIFNA-N
InChICode InChI=1S/C13H13NO6/c15-9-4-1-8(2-5-9)3-6-11(16)14-10(13(19)20)7-12(17)18/h1-6,10,15H,7H2,(H,14,16)(H,17,18)(H,19,20)/b6-3+/t10-/m1/s1
SMILES c1(ccc(cc1)/C=C/C(=O)N[C@H](CC(=O)O)C(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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OrganismArabidopsis thaliana
ReferenceMock,Phytochem.,34,(1993),157