CHEBI:58220 - N-adenylyl-L-phenylalanate(2−)

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ChEBI Name N-adenylyl-L-phenylalanate(2−)
ChEBI ID CHEBI:58220
ChEBI ASCII Name N-adenylyl-L-phenylalanate(2-)
Definition A doubly-charged α-amino-acid anion arising from deprotonation of the carboxy and phosphate groups of N-adenylyl-L-phenylalanine; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H21N6O8P
Net Charge -2
Average Mass 492.37920
Monoisotopic Mass 492.11695
InChI InChI=1S/C19H23N6O8P/c20-16-13-17(22-8-21-16)25(9-23-13)18-15(27)14(26)12(33-18)7-32-34(30,31)24-11(19(28)29)6-10-4-2-1-3-5-10/h1-5,8-9,11-12,14-15,18,26-27H,6-7H2,(H,28,29)(H2,20,21,22)(H2,24,30,31)/p-2/t11-,12+,14+,15+,18+/m0/s1
InChIKey OXCQKAQOLIIWJO-URQYDQELSA-L
SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP([O-])(=O)N[C@@H](Cc2ccccc2)C([O-])=O)[C@@H](O)[C@H]1O
ChEBI Ontology
Outgoing N-adenylyl-L-phenylalanate(2−) (CHEBI:58220) is a α-amino-acid anion (CHEBI:33558)
N-adenylyl-L-phenylalanate(2−) (CHEBI:58220) is a organophosphate oxoanion (CHEBI:58945)
N-adenylyl-L-phenylalanate(2−) (CHEBI:58220) is conjugate base of N-adenylyl-L-phenylalanine (CHEBI:17648)
Incoming N-adenylyl-L-phenylalanine (CHEBI:17648) is conjugate acid of N-adenylyl-L-phenylalanate(2−) (CHEBI:58220)
IUPAC Name
5'-O-({[(1S)-1-carboxylato-2-phenylethyl]amino}phosphinato)adenosine
Synonyms Sources
N-adenylyl-L-phenylalanate ChEBI
N-adenylyl-L-phenylalanate(2−) ChEBI
N-adenylyl-L-phenylalanine UniProt
Last Modified
09 May 2014