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CHEBI:227803 - Kipukasin G

ChEBI IDCHEBI:227803
ChEBI NameKipukasin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22N2O9
Net Charge0
Average Mass422.390
Monoisotopic Mass422.13253
SMILESCOc1cc(O)cc(C)c1C(=O)O[C@H]1[C@@H](O)[C@H](n2ccc(=O)n(C)c2=O)O[C@@H]1CO
InChIInChI=1S/C19H22N2O9/c1-9-6-10(23)7-11(28-3)14(9)18(26)30-16-12(8-22)29-17(15(16)25)21-5-4-13(24)20(2)19(21)27/h4-7,12,15-17,22-23,25H,8H2,1-3H3/t12-,15-,16-,17-/m1/s1
InChIKeyCIJRLBYKDKLPQB-BASLNEPJSA-N
Species of MetaboliteComponentSourceComments
Aspergillus versicolor (ncbitaxon:46472) - PubMed (17608440)
ChEBI Ontology
Outgoing Relation(s)
Kipukasin G (CHEBI:227803) is a pyrimidine nucleoside (CHEBI:26440)
IUPAC Name 
[(2R,3S,4R,5R)-4-hydroxy-2-(hydroxymethyl)-5-(3-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] 4-hydroxy-2-methoxy-6-methylbenzoate
Manual XrefsDatabases
78440448ChemSpider