CHEBI:60114 - α,α-trehalose-2-sulfate

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ChEBI Name α,α-trehalose-2-sulfate ChEBI ID CHEBI:60114 ChEBI ASCII Name alpha,alpha-trehalose-2-sulfate Definition The 2-O-sulfo derivative of α,α-trehalose. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H22O14S Net Charge 0 Average Mass 422.36000 Monoisotopic Mass 422.07303 InChI InChI=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)/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1 InChIKey WVFKPISWLUJJIJ-LIZSDCNHSA-N SMILES OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OS(O)(=O)=O)[C@H](O)[C@@H](O)[C@@H]1O ChEBI Ontology Outgoing α,α-trehalose-2-sulfate (CHEBI:60114) has functional parent α,α-trehalose (CHEBI:16551) α,α-trehalose-2-sulfate (CHEBI:60114) is a trehalose sulfate (CHEBI:60117) α,α-trehalose-2-sulfate (CHEBI:60114) is conjugate acid of α,α-trehalose-2-sulfate(1−) (CHEBI:60091) Incoming α,α-trehalose-2-sulfate(1−) (CHEBI:60091) is conjugate base of α,α-trehalose-2-sulfate (CHEBI:60114) IUPAC Name 2-O-sulfo-α-D-glucopyranosyl α-D-glucopyranoside Synonyms Sources 2-O-Sulfotrehalose ChemIDplus 2-Sulfotrehalose ChemIDplus Trehalose 2-sulfate ChemIDplus Registry Numbers Types Sources 141923-45-7 CAS Registry Number ChemIDplus 1668481 Beilstein Registry Number Beilstein Last Modified 24 August 2010