CHEBI:62120 - 2-O-palmitoyl-2'-O-sulfo-3-O-triacontanoyl-α,α-trehalose

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ChEBI Name 2-O-palmitoyl-2'-O-sulfo-3-O-triacontanoyl-α,α-trehalose ChEBI ID CHEBI:62120 ChEBI ASCII Name 2-O-palmitoyl-2'-O-sulfo-3-O-triacontanoyl-alpha,alpha-trehalose Definition A sulfoglycolipid in which α,α-trehalose, sulfated at the 2'-position, is acylated at the 2-position with palmitic acid, and at the 3-position with triacontanoic acid. 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 C58H110O16S Net Charge 0 Average Mass 1095.54900 Monoisotopic Mass 1094.75146 InChI InChI=1S/C58H110O16S/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-34-35-37-39-41-43-49(61)71-54-52(64)48(46-60)70-58(73-57-55(74-75(66,67)68)53(65)51(63)47(45-59)69-57)56(54)72-50(62)44-42-40-38-36-33-31-16-14-12-10-8-6-4-2/h47-48,51-60,63-65H,3-46H2,1-2H3,(H,66,67,68)/t47-,48-,51-,52-,53+,54+,55-,56-,57-,58-/m1/s1 InChIKey LJXQGLZBCCMZOI-RQQDWODESA-N SMILES CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OS(O)(=O)=O)[C@@H]1OC(=O)CCCCCCCCCCCCCCC ChEBI Ontology Outgoing 2-O-palmitoyl-2'-O-sulfo-3-O-triacontanoyl-α,α-trehalose (CHEBI:62120) has functional parent α,α-trehalose (CHEBI:16551) 2-O-palmitoyl-2'-O-sulfo-3-O-triacontanoyl-α,α-trehalose (CHEBI:62120) is a sulfoglycolipid (CHEBI:26829) IUPAC Name 2-O-palmitoyl-3-O-triacontanoyl-α-D-glucopyranosyl 2-O-sulfo-α-D-glucopyranoside Citation Type Source 19454700 PubMed citation Europe PMC Last Modified 25 July 2011