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CHEBI:42217 - (2R,3Z)-4-{[(4-amino-2-methylpyrimidin-5-yl)methyl]amino}-2-hydroxy-3-sulfanylpent-3-en-1-yl trihydrogen diphosphate

ChEBI IDCHEBI:42217
ChEBI Name(2R,3Z)-4-{[(4-amino-2-methylpyrimidin-5-yl)methyl]amino}-2-hydroxy-3-sulfanylpent-3-en-1-yl trihydrogen diphosphate
Stars
ASCII Name(2R,3Z)-4-{[(4-amino-2-methylpyrimidin-5-yl)methyl]amino}-2-hydroxy-3-sulfanylpent-3-en-1-yl trihydrogen diphosphate
Last Modified20 February 2008
DownloadsMolfile
FormulaC11H20N4O8P2S
Net Charge0
Average Mass430.316
Monoisotopic Mass430.04771
SMILES[H]O[C@@]([H])(/C(S[H])=C(/N([H])C([H])([H])c1c([H])nc(C([H])([H])[H])nc1N([H])[H])C([H])([H])[H])C([H])([H])O[P@](=O)(O[H])OP(=O)(O[H])O[H]
InChIInChI=1S/C11H20N4O8P2S/c1-6(13-3-8-4-14-7(2)15-11(8)12)10(26)9(16)5-22-25(20,21)23-24(17,18)19/h4,9,13,16,26H,3,5H2,1-2H3,(H,20,21)(H2,12,14,15)(H2,17,18,19)/b10-6-/t9-/m1/s1
InChIKeyXHCFSNVIKLFNIT-WPVMNKCKSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3Z)-4-{[(4-amino-2-methylpyrimidin-5-yl)methyl]amino}-2-hydroxy-3-sulfanylpent-3-en-1-yl trihydrogen diphosphate (CHEBI:42217) is a alkyl diphosphate (CHEBI:46731)
(2R,3Z)-4-{[(4-amino-2-methylpyrimidin-5-yl)methyl]amino}-2-hydroxy-3-sulfanylpent-3-en-1-yl trihydrogen diphosphate (CHEBI:42217) is a aminopyrimidine (CHEBI:38338)
Synonyms  Source
MONO-{4-[(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-AMINO]-2-HYDROXY-3-MERCAPTO-PENT-3-ENYL-PHOSPHONO} ESTERPDBeChem
(2R,3Z)-4-{[(4-amino-2-methylpyrimidin-5-yl)methyl]amino}-2-hydroxy-3-sulfanylpent-3-en-1-yl trihydrogen diphosphatePDBeChem
Manual XrefsDatabases
DPXPDBeChem