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CHEBI:228707 - 6-Thioinosine-phosphate

ChEBI IDCHEBI:228707
ChEBI Name6-Thioinosine-phosphate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H13N4O7PS
Net Charge0
Average Mass364.276
Monoisotopic Mass364.02426
SMILESO=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(=S)ncnc32)C(O)[C@H]1O
InChIInChI=1S/C10H13N4O7PS/c15-6-4(1-20-22(17,18)19)21-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)23/h2-4,6-7,10,15-16H,1H2,(H,11,12,23)(H2,17,18,19)/t4-,6+,7?,10-/m1/s1
InChIKeyZKRFOXLVOKTUTA-PKJMTWSGSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
6-Thioinosine-phosphate (CHEBI:228707) is a purine ribonucleoside monophosphate (CHEBI:26397)
IUPAC Name 
[(2R,3R,5R)-3,4-dihydroxy-5-(6-sulanylidene-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate
Manual XrefsDatabases
71116086ChemSpider