1-O-(4-O-beta-D-Galactopyranosyl-beta-glucopyranosyl)ceramide
[CAS# 4682-48-8]

Identification

• Name: 1-O-(4-O-beta-D-Galactopyranosyl-beta-glucopyranosyl)ceramide
• Synonyms: N-[(E)-1-[[(2R,3R,4R,5R,6R)-3,4-Dihydroxy-6-(Hydroxymethyl)-5-[(3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-2-Hydroxy-Heptadec-3-Enyl]Octadecanamide; N-[(E)-1-[[(2R,3R,4R,5R,6R)-3,4-Dihydroxy-6-(Hydroxymethyl)-5-[[(3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxymethyl]-2-Hydroxyheptadec-3-Enyl]Octadecanamide; N-[(E)-1-[[(2R,3R,4R,5R,6R)-3,4-Dihydroxy-6-Methylol-5-[(3R,4S,5R,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-2-Hydroxy-Heptadec-3-Enyl]Stearamide
• Molecular Formula: C₄₈H₉₁NO₁₃
• Molecular Weight: 890.25
• CAS Registry Number: 4682-48-8
• SMILES: [C@@H]2(OC1O[C@@H]([C@H](O)[C@H](O)[C@H]1O)CO)[C@H](O)[C@@H](O)[C@@H](O[C@@H]2CO)OCC(NC(=O)CCCCCCCCCCCCCCCCC)C(O)\C=C\CCCCCCCCCCCCC
• InChI: 1S/C48H91NO13/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(53)49-36(37(52)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2)35-59-47-45(58)43(56)46(39(34-51)61-47)62-48-44(57)42(55)41(54)38(33-50)60-48/h29,31,36-39,41-48,50-52,54-58H,3-28,30,32-35H2,1-2H3,(H,49,53)/b31-29+/t36?,37?,38-,39-,41+,42+,43-,44-,45-,46+,47-,48?/m1/s1
• InChIKey: VOZHMDQUIRUFQW-AIRKALMMSA-N