EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:45967 - (2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine

ChEBI IDCHEBI:45967
ChEBI Name(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine
Stars
ASCII Name(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine
Last Modified20 September 2012
DownloadsMolfile
FormulaC12H17N2O9P
Net Charge0
Average Mass364.247
Monoisotopic Mass364.06717
SMILES[H]O[C@@]12C([H])([H])C([H])([H])O[C@]1([H])[C@]([H])(n1c([H])c(C([H])([H])[H])c(=O)n([H])c1=O)O[C@]2([H])C([H])([H])OP(=O)(O[H])O[H]
InChIInChI=1S/C12H17N2O9P/c1-6-4-14(11(16)13-9(6)15)10-8-12(17,2-3-21-8)7(23-10)5-22-24(18,19)20/h4,7-8,10,17H,2-3,5H2,1H3,(H,13,15,16)(H2,18,19,20)/t7-,8-,10-,12-/m1/s1
InChIKeyGYCSZLSGLYHOGR-FWSPBBIJSA-N
ChEBI Ontology
Outgoing Relation(s)
(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine (CHEBI:45967) has functional parent thymine (CHEBI:17821)
(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine (CHEBI:45967) is a arabinose phosphate (CHEBI:22600)
(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine (CHEBI:45967) is a arabinoside (CHEBI:22601)
(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine (CHEBI:45967) is a monosaccharide derivative (CHEBI:63367)
(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine (CHEBI:45967) is a oxabicycloalkane (CHEBI:46733)
(2-O,3-ethane-1,2-diyl-5-O-phosphonoarabinofuranosyl)thymine (CHEBI:45967) is a pyrimidine nucleotide (CHEBI:26441)
Synonym  Source
[(3aR,4R,6R,6aS)-3a-hydroxy-6-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)hexahydrofuro[3,4-b]furan-4-yl]methyl dihydrogen phosphatePDBeChem
Manual XrefsDatabases
TLCPDBeChem