MetaCyc Compound: D,L-5-fluorotryptophan

Chemical Formula: C11H11N2O2F

Monoisotopic Molecular Weight: 222.0804558077 Daltons

D,L-5-fluorotryptophan compound structure

SMILES: C1(C(=CC2(=C(C=1)NC=C2CC(C(=O)[O-])[N+]))F)

InChI: InChI=1S/C11H11FN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)


Unification Links: ChEBI:77837 , PubChem:25245343

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): 25.133322 Inferred by computational analysis [Latendresse13]

This compound has been characterized as an alternative substrate of the following enzymes: L-tryptophan aminotransferase , Transport of an aromatic amino acid , tryptophan dioxygenase


Latendresse13: Latendresse M. (2013). "Computing Gibbs Free Energy of Compounds and Reactions in MetaCyc."

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Please cite the following article in publications resulting from the use of MetaCyc: Caspi et al, Nucleic Acids Research 42:D459-D471 2014
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