CHEBI:62497 - 7-(3-methylbut-2-enyl)-L-tryptophan zwitterion

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ChEBI Name 7-(3-methylbut-2-enyl)-L-tryptophan zwitterion
ChEBI ID CHEBI:62497
ChEBI ASCII Name 7-(3-methylbut-2-enyl)-L-tryptophan zwitterion
Definition An amino acid zwitterion obtained by transfer of a proton from the carboxy group to the primary amino group of 7-(3-methylbut-2-enyl)-L-tryptophan. Major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H20N2O2
Net Charge 0
Average Mass 272.34220
Monoisotopic Mass 272.15248
InChI InChI=1S/C16H20N2O2/c1-10(2)6-7-11-4-3-5-13-12(9-18-15(11)13)8-14(17)16(19)20/h3-6,9,14,18H,7-8,17H2,1-2H3,(H,19,20)/t14-/m0/s1
InChIKey OLFAGKNOXHVNHG-AWEZNQCLSA-N
SMILES CC(C)=CCc1cccc2c(C[C@H]([NH3+])C([O-])=O)c[nH]c12
ChEBI Ontology
Outgoing 7-(3-methylbut-2-enyl)-L-tryptophan zwitterion (CHEBI:62497) is a amino acid zwitterion (CHEBI:35238)
7-(3-methylbut-2-enyl)-L-tryptophan zwitterion (CHEBI:62497) is tautomer of 7-(3-methylbut-2-enyl)-L-tryptophan (CHEBI:59356)
Incoming 7-(3-methylbut-2-enyl)-L-tryptophan (CHEBI:59356) is tautomer of 7-(3-methylbut-2-enyl)-L-tryptophan zwitterion (CHEBI:62497)
IUPAC Name
(2S)-2-ammonio-3-[7-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]propanoate
Synonym Source
7-(3-methylbut-2-enyl)-L-tryptophan UniProt
Manual Xref Database
CPD-12156 MetaCyc
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Last Modified
04 July 2011