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N-acetyl-D-tryptophanate

Go to external page http://purl.obolibrary.org/obo/CHEBI_57877

The conjugate base of N-acetyl-D-tryptophan; major species at pH 7.3.

Term info

Label

N-acetyl-D-tryptophanate

Synonyms
  • (2R)-2-acetamido-3-(1H-indol-3-yl)propanoate
  • N-acetyl-D-tryptophanate
database cross reference
Subsets

3_STAR

IUPAC NAME
(2R)-2-acetamido-3-(1H-indol-3-yl)propanoate [ IUPAC ]

IUPAC NAME
N-acetyl-D-tryptophanate [ IUPAC ]

charge

-1

formula

C13H13N2O3

has obo namespace

chebi_ontology

has related synonym

N-acetyl-D-tryptophanate anion, N-acetyl-D-tryptophanate(1-), N-acetyl-D-tryptophan

id

CHEBI:57877

inchi

InChI=1S/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/p-1/t12-/m1/s1

inchikey

DZTHIGRZJZPRDV-GFCCVEGCSA-M

mass

245.25390

monoisotopicmass

245.09262

smiles

CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C([O-])=O