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CHEBI:42771 - 1'-((1,4-DIDEOXY-1,4-IMINO-D-ARABINITOL)-4-N-AMMONIUM)-1'-DEOXY-L-ERYTHRITOL-3'-SULFATE INNER SALT

Default Structure
ChEBI IDCHEBI:42771
ChEBI Name1'-((1,4-DIDEOXY-1,4-IMINO-D-ARABINITOL)-4-N-AMMONIUM)-1'-DEOXY-L-ERYTHRITOL-3'-SULFATE INNER SALT
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC9H18NO9S
Net Charge-3
Average Mass316.308
Monoisotopic Mass316.07187
SMILES[H]OC([H])([H])[C@]([H])(O[S@TB6]([O-])([O-])[O-])[C@]([H])(O[H])C([H])([H])N1C([H])([H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]1([H])C([H])([H])O[H]
InChIInChI=1S/C9H21NO9S/c11-3-5-9(15)7(14)2-10(5)1-6(13)8(4-12)19-20(16,17)18/h5-9,11-18H,1-4H2/p-3/t5-,6-,7-,8+,9-/m1/s1
InChIKeyYWOSRVQDYDWMAB-GOFVFXDOSA-K
ChEBI Ontology
Outgoing Relation(s)
1'-((1,4-DIDEOXY-1,4-IMINO-D-ARABINITOL)-4-N-AMMONIUM)-1'-DEOXY-L-ERYTHRITOL-3'-SULFATE INNER SALT (CHEBI:42771) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1'-((1,4-DIDEOXY-1,4-IMINO-D-ARABINITOL)-4-N-AMMONIUM)-1'-DEOXY-L-ERYTHRITOL-3'-SULFATE INNER SALTPDBeChem
({[(1S,2R)-3-[(2R,3R,4R)-3,4-dihydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]-2-hydroxy-1-(hydroxymethyl)propyl]oxy}-lambda~4~-sulfanetriyl)trioxidanidePDBeChem
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