N-[(2S,3S)-1-(beta-D-Glucopyranosyloxy)-3-Hydroxy-2-Nonadecanyl]Octadecanamide
[CAS# 104443-57-4]

Identification

• Name: N-[(2S,3S)-1-(beta-D-Glucopyranosyloxy)-3-Hydroxy-2-Nonadecanyl]Octadecanamide
• Synonyms: CID_445946; GM2; N-[(1S,2S)-2-HYDROXY-1-({[(2R,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2-YL]OXY}METHYL)OCTADECYL]OCTADECANAMIDE
• Molecular Formula: C₄₃H₈₅NO₈
• Molecular Weight: 744.14
• CAS Registry Number: 104443-57-4
• SMILES: O=C(N[C@@H](CO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)[C@@H](O)CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC
• InChI: 1S/C43H85NO8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39(47)44-36(35-51-43-42(50)41(49)40(48)38(34-45)52-43)37(46)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36-38,40-43,45-46,48-50H,3-35H2,1-2H3,(H,44,47)/t36-,37-,38+,40+,41-,42+,43+/m0/s1
• InChIKey: SYMIJCRAJBNLEL-YPQBUIQASA-N

Properties

• Density: 1.04g/cm³ (Cal.)
• Boiling point: 858.64°C at 760 mmHg (Cal.)
• Flash point: 473.088°C (Cal.)
• Refractive index: 1.51 (Cal.)