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CHEBI:40749 - PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER

Default Structure
ChEBI IDCHEBI:40749
ChEBI NamePHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC10H17N6O12P3
Net Charge0
Average Mass506.198
Monoisotopic Mass506.01173
SMILES[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(n2c([H])nc3c(N([H])[H])nc([H])nc32)O[C@]1([H])C([H])([H])O[P@](=O)(O[H])O[P@](=O)(O[H])N([H])P(=O)(O[H])O[H]
InChIInChI=1S/C10H17N6O12P3/c11-8-5-9(13-2-12-8)16(3-14-5)10-7(18)6(17)4(27-10)1-26-31(24,25)28-30(22,23)15-29(19,20)21/h2-4,6-7,10,17-18H,1H2,(H,24,25)(H2,11,12,13)(H4,15,19,20,21,22,23)/t4-,6-,7-,10-/m1/s1
InChIKeyPVKSNHVPLWYQGJ-KQYNXXCUSA-N
ChEBI Ontology
Outgoing Relation(s)
PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER (CHEBI:40749) is a unclassifieds (CHEBI:27189)
Synonyms  Source
5'-O-[(S)-hydroxy{[(R)-hydroxy(phosphonoamino)phosphoryl]oxy}phosphoryl]adenosinePDBeChem
PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTERPDBeChem
Manual XrefsDatabases
ANPPDBeChem