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CHEBI:77909 - sodium (allyl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onate

ChEBI IDCHEBI:77909
ChEBI Namesodium (allyl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onate
Stars
ASCII Namesodium (allyl 3-deoxy-7-O-methyl-alpha-D-manno-oct-2-ulopyranosid)onate
DefinitionThe sodium salt of (allyl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onic acid.
Last Modified31 March 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC12H19O8.Na
Net Charge0
Average Mass314.266
Monoisotopic Mass314.09776
SMILES[H][C@]1([C@@H](CO)OC)O[C@@](OCC=C)(C(=O)[O-])C[C@@H](O)[C@H]1O.[Na+]
InChIInChI=1S/C12H20O8.Na/c1-3-4-19-12(11(16)17)5-7(14)9(15)10(20-12)8(6-13)18-2;/h3,7-10,13-15H,1,4-6H2,2H3,(H,16,17);/q;+1/p-1/t7-,8-,9-,10-,12-;/m1./s1
InChIKeyXUYWQXIIWPDKLJ-MRWDGOKWSA-M
ChEBI Ontology
Outgoing Relation(s)
sodium (allyl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onate (CHEBI:77909) has part (allyl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onate (CHEBI:77910)
sodium (allyl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onate (CHEBI:77909) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
sodium (prop-2-en-1-yl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onate
Synonyms  Source
sodium allyl (6S)-3-deoxy-6-[(1R)-2-hydroxy-1-methoxyethyl]-β-L-erythro-hex-2-ulopyranosidonateIUPAC
(allyl 3-deoxy-7-O-methyl-α-D-manno-oct-2-ulopyranosid)onic acid sodium saltChEBI
7-O-methyl-Kdo allyl glycoside sodium saltChEBI
Registry NumbersSources
Reaxys:19681948Reaxys
Citations