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CHEBI:40467 - 5'-{[2-(aminooxy)ethyl](methyl)sulfonio}-5'-deoxyadenosine

ChEBI IDCHEBI:40467
ChEBI Name5'-{[2-(aminooxy)ethyl](methyl)sulfonio}-5'-deoxyadenosine
Stars
Last Modified8 December 2015
DownloadsMolfile
FormulaC13H21N6O4S
Net Charge+1
Average Mass357.416
Monoisotopic Mass357.13395
SMILESC[S+](CCON)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
InChIInChI=1S/C13H21N6O4S/c1-24(3-2-22-15)4-7-9(20)10(21)13(23-7)19-6-18-8-11(14)16-5-17-12(8)19/h5-7,9-10,13,20-21H,2-4,15H2,1H3,(H2,14,16,17)/q+1/t7-,9-,10-,13-,24?/m1/s1
InChIKeyRMAOLICYOBWFLA-VCZNENMGSA-N
ChEBI Ontology
Outgoing Relation(s)
5'-{[2-(aminooxy)ethyl](methyl)sulfonio}-5'-deoxyadenosine (CHEBI:40467) is a adenosines (CHEBI:22260)
5'-{[2-(aminooxy)ethyl](methyl)sulfonio}-5'-deoxyadenosine (CHEBI:40467) is a sulfonium compound (CHEBI:26830)
IUPAC Name 
[1-(adenin-9-yl)-1,5-dideoxy-β-D-ribofuranos-5-yl][2-(aminooxy)ethyl](methyl)sulfonium
Synonym  Source
(2-AMINOOXY-ETHYL)-[5-(6-AMINO-PURIN-9-YL)-3,4-DIHYDROXY-TETRAHYDRO-FURAN-2-YLMETHYL]-METHYL-SULFONIUMPDBeChem
Manual XrefsDatabases
AADPDBeChem
Registry NumbersSources
Beilstein:9088644Beilstein