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CHEBI:1958 - 5'-dehydroadenosine

ChEBI IDCHEBI:1958
ChEBI Name5'-dehydroadenosine
Stars
DefinitionA member of the class of adenosines that is 5'-dehydro derivative of adenosine.
Last Modified30 March 2016
DownloadsMolfile
FormulaC10H11N5O4
Net Charge0
Average Mass265.229
Monoisotopic Mass265.08110
SMILES[H]C(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
InChIInChI=1S/C10H11N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h1-4,6-7,10,17-18H,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
InChIKeyCWNMDMYGRVHXDR-KQYNXXCUSA-N
ChEBI Ontology
Outgoing Relation(s)
5'-dehydroadenosine (CHEBI:1958) is a adenosines (CHEBI:22260)
IUPAC Name 
5'-deoxy-5'-oxoadenosine
Synonyms  Source
5'-DehydroadenosineKEGG COMPOUND
9-β-D-ribo-pentodialdo-1,4-furanosyl-9H-purin-6-amineIUPAC
UniProt Name  Source
5'-dehydroadenosineUniProt
Manual XrefsDatabases
C11500KEGG COMPOUND
CPD-12766MetaCyc
Registry NumbersSources
Reaxys:564838Reaxys
CAS:3110-98-3ChemIDplus
Citations