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CHEBI:40502 - (S)-(N-PHENYL-2-HYDROXY-ETHYL)-2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE

Default Structure
ChEBI IDCHEBI:40502
ChEBI Name(S)-(N-PHENYL-2-HYDROXY-ETHYL)-2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC18H22N5O7P
Net Charge0
Average Mass451.376
Monoisotopic Mass451.12568
SMILES[H]O[C@@]([H])(c1c([H])c([H])c([H])c([H])c1[H])C([H])([H])N([H])c1nc([H])nc2c1nc([H])n2[C@]1([H])O[C@]([H])(C([H])([H])OP(=O)(O[H])O[H])[C@@]([H])(O[H])C1([H])[H]
InChIInChI=1S/C18H22N5O7P/c24-12-6-15(30-14(12)8-29-31(26,27)28)23-10-22-16-17(20-9-21-18(16)23)19-7-13(25)11-4-2-1-3-5-11/h1-5,9-10,12-15,24-25H,6-8H2,(H,19,20,21)(H2,26,27,28)/t12-,13+,14+,15+/m0/s1
InChIKeyXQQQZMWASYSYAT-GBJTYRQASA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-(N-PHENYL-2-HYDROXY-ETHYL)-2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE (CHEBI:40502) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2'-deoxy-N-[(2S)-2-hydroxy-2-phenylethyl]adenosine 5'-(dihydrogen phosphate)PDBeChem
(S)-(N-PHENYL-2-HYDROXY-ETHYL)-2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATEPDBeChem
Manual XrefsDatabases
ABSPDBeChem