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CHEBI:132139 - (R)-demethyl-4-deoxygadusol(1−)

ChEBI IDCHEBI:132139
ChEBI Name(R)-demethyl-4-deoxygadusol(1−)
Stars
ASCII Name(R)-demethyl-4-deoxygadusol(1-)
DefinitionAn organic anion obtained by deprotonation of one of the hydroxy groups of (R)-demethyl-4-deoxygadusol. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified18 May 2023
SubmitterAnne Morgat
DownloadsMolfile
FormulaC7H9O5
Net Charge-1
Average Mass173.144
Monoisotopic Mass173.04555
SMILESO=C1C[C@@](O)(CO)CC([O-])=C1O
InChIInChI=1S/C7H10O5/c8-3-7(12)1-4(9)6(11)5(10)2-7/h8-9,11-12H,1-3H2/p-1/t7-/m1/s1
InChIKeyOWHGXOODGNBQRG-SSDOTTSWSA-M
ChEBI Ontology
Outgoing Relation(s)
(R)-demethyl-4-deoxygadusol(1−) (CHEBI:132139) is a organic anion (CHEBI:25696)
(R)-demethyl-4-deoxygadusol(1−) (CHEBI:132139) is conjugate base of (R)-demethyl-4-deoxygadusol (CHEBI:132137)
Incoming Relation(s)
(R)-demethyl-4-deoxygadusol (CHEBI:132137) is conjugate acid of (R)-demethyl-4-deoxygadusol(1−) (CHEBI:132139)
UniProt Name  Source
(R)-demethyl-4-deoxygadusolUniProt
Citations