CHEBI:60091 - α,α-trehalose-2-sulfate(1−)

ChEBI IDCHEBI:60091
ChEBI Nameα,α-trehalose-2-sulfate(1−)
Stars
ASCII Namealpha,alpha-trehalose-2-sulfate(1-)
DefinitionThe conjugate base of α,α-trehalose-2-sulfate arising from deprotonation of the sulfate group.
Last Modified24 April 2014
SubmitterR. Stephan
DownloadsMolfile
FormulaC12H21O14S
Net Charge-1
Average Mass421.353
Monoisotopic Mass421.06575
SMILESO=S(=O)([O-])O[C@H]1[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C12H22O14S/c13-1-3-5(15)7(17)9(19)11(23-3)25-12-10(26-27(20,21)22)8(18)6(16)4(2-14)24-12/h3-19H,1-2H2,(H,20,21,22)/p-1/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1
InChIKeyWVFKPISWLUJJIJ-LIZSDCNHSA-M
ChEBI Ontology
Outgoing Relation(s)
α,α-trehalose-2-sulfate(1−) (CHEBI:60091) has functional parent α,α-trehalose (CHEBI:16551)
α,α-trehalose-2-sulfate(1−) (CHEBI:60091) is a organosulfate oxoanion (CHEBI:58958)
α,α-trehalose-2-sulfate(1−) (CHEBI:60091) is conjugate base of α,α-trehalose-2-sulfate (CHEBI:60114)
Incoming Relation(s)
sulfolipid-1 (CHEBI:194130) has functional parent α,α-trehalose-2-sulfate(1−) (CHEBI:60091)
α,α-trehalose-2-sulfate (CHEBI:60114) is conjugate acid of α,α-trehalose-2-sulfate(1−) (CHEBI:60091)
IUPAC Name 
2-O-sulfonato-α-D-glucopyranosyl α-D-glucopyranoside
Synonym  Source
α,α-trehalose-2-sulfate anionChEBI
UniProt Name  Source
2-O-sulfo-α,α-trehaloseUniProt
Citations