input word = C00000117

Metabolite InformationStructural formula
Name Indole-3-acetyl-L-aspartic acid
Formula C14H14N2O5
Mw 290.09027157
CAS RN 2456-73-7
C_ID C00000117 ,
InChIKey VAFNMNRKDDAKRM-UHFFFAOYNA-N
InChICode InChI=1S/C14H14N2O5/c17-12(16-11(14(20)21)6-13(18)19)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)/t11-/m1/s1
SMILES O=C(O)CC(NC(=O)Cc1c[nH]c2ccccc12)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeFabaceaeGlycine max Ref.
PlantaeFabaceaeGlycine max. Ref.
PlantaeFabaceaeLupinus angustifolius Ref.
PlantaeFabaceaePisum sativum Ref.
PlantaeMagnoliaceaeMagnolia sp. Ref.
PlantaePapaveraceaePapaver somniferum Ref.
PlantaeSolanaceaeSolanum lycopersicum Ref.
--Gleditschia triacanthos Ref.
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