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CHEBI:181457 - (2S)-2-Amino-4-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]butanoic acid

ChEBI IDCHEBI:181457
ChEBI Name(2S)-2-Amino-4-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]butanoic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20N6O5S
Net Charge0
Average Mass384.418
Monoisotopic Mass384.12159
SMILESNc1ncnc2c1ncn2C1OC(CSCCC(N)C(=O)O)C(O)C1O
InChIInChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)
InChIKeyZJUKTBDSGOFHSH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S)-2-Amino-4-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulfanyl]butanoic acid (CHEBI:181457) is a nucleobase-containing molecular entity (CHEBI:61120)
IUPAC Name 
2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylsulanyl]butanoic acid
Manual XrefsDatabases
188ChemSpider
C00021KEGG COMPOUND