input word = C00000121

Metabolite InformationStructural formula
Name alpha-N-Carboethoxyacetyl-D-4-chlorotryptophan
Formula C16H17ClN2O5
Mw 352.08259938
CAS RN 27564-24-5
C_ID C00000121 ,
InChIKey DWVLUSJVGYOTDB-STGVRZAANA-N
InChICode InChI=1S/C16H17ClN2O5/c1-2-24-14(21)7-13(20)19-12(16(22)23)6-9-8-18-11-5-3-4-10(17)15(9)11/h3-5,8,12,18H,2,6-7H2,1H3,(H,19,20)(H,22,23)/t12-/m1/s1
SMILES c1(c2c(ccc1)[nH]cc2C[C@@H](NC(=O)CC(=O)OCC)C(=O)O)Cl
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
PlantaeFabaceaePisum sativum Ref.
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