CHEBI:63531 - 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl β-D-galactosyl-(1→4)-β-D-glucoside

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl β-D-galactosyl-(1→4)-β-D-glucoside ChEBI ID CHEBI:63531 ChEBI ASCII Name 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl beta-D-galactosyl-(1->4)-beta-D-glucoside Definition A glycoside that consists of β-D-galactosyl-(1→4)-β-D-glucose where the hydrogen of the anomeric OH group is substituted by a 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl group. 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 C48H94O15S2 Net Charge 0 Average Mass 975.38100 Monoisotopic Mass 974.60341 InChI InChI=1S/C48H94O15S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-64(56,57)36-38(37-65(58,59)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)35-60-47-45(55)43(53)46(40(34-50)62-47)63-48-44(54)42(52)41(51)39(33-49)61-48/h38-55H,3-37H2,1-2H3/t39-,40-,41+,42+,43-,44-,45-,46-,47-,48+/m1/s1 InChIKey ZJEIXRMBHAATLQ-LAWZUEHLSA-N SMILES CCCCCCCCCCCCCCCCS(=O)(=O)CC(CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)CS(=O)(=O)CCCCCCCCCCCCCCCC ChEBI Ontology Outgoing 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl β-D-galactosyl-(1→4)-β-D-glucoside (CHEBI:63531) has functional parent lactose (CHEBI:17716) 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl β-D-galactosyl-(1→4)-β-D-glucoside (CHEBI:63531) is a disaccharide derivative (CHEBI:63353) 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl β-D-galactosyl-(1→4)-β-D-glucoside (CHEBI:63531) is a glycoside (CHEBI:24400) 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl β-D-galactosyl-(1→4)-β-D-glucoside (CHEBI:63531) is a sulfone (CHEBI:35850) IUPAC Name 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl β-D-galactopyranosyl-(1→4)-β-D-glucopyranoside Synonyms Sources 3-(hexadecylsulfonyl)-2-[(hexadecylsulfonyl)methyl]propyl 4-O-β-D--galactopyranosyl-β-D--glucopyranoside IUPAC lactose-bisulfone ChEBI Registry Number Type Source 4229106 Reaxys Registry Number Reaxys Citation Type Source 10023770 PubMed citation Europe PMC Last Modified 20 September 2012