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CHEBI:58156 - N-adenylylanthranilate

ChEBI IDCHEBI:58156
ChEBI NameN-adenylylanthranilate
Stars
ASCII NameN-adenylylanthranilate
DefinitionDianion of N-adenylylanthranilic acid arising from deprotonation of the carboxy and phosphoramidate OH groups; major species at pH 7.3.
Last Modified16 February 2016
DownloadsMolfile
FormulaC17H17N6O8P
Net Charge-2
Average Mass464.331
Monoisotopic Mass464.08565
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])Nc2ccccc2C(=O)[O-])[C@@H](O)[C@H]1O
InChIInChI=1S/C17H19N6O8P/c18-14-11-15(20-6-19-14)23(7-21-11)16-13(25)12(24)10(31-16)5-30-32(28,29)22-9-4-2-1-3-8(9)17(26)27/h1-4,6-7,10,12-13,16,24-25H,5H2,(H,26,27)(H2,18,19,20)(H2,22,28,29)/p-2/t10-,12-,13-,16-/m1/s1
InChIKeyVRPRDYILQKJWNN-XNIJJKJLSA-L
ChEBI Ontology
Outgoing Relation(s)
N-adenylylanthranilate (CHEBI:58156) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
N-adenylylanthranilate (CHEBI:58156) is a organic phosphoramidate anion (CHEBI:60345)
N-adenylylanthranilate (CHEBI:58156) is conjugate base of N-adenylylanthranilic acid (CHEBI:17469)
Incoming Relation(s)
N-adenylylanthranilic acid (CHEBI:17469) is conjugate acid of N-adenylylanthranilate (CHEBI:58156)
IUPAC Name 
5'-O-{[(2-carboxylatophenyl)amino]phosphinato}adenosine
Synonyms  Source
N-adenylylanthranilate(2−)ChEBI
N-adenylylanthranilate dianionChEBI
UniProt Name  Source
N-adenylylanthranilateUniProt