N-Dodecanoyl-NBD-lactosylceramide

• Synonyms: N-Dodecanoyl-NBD-beta-D-lactosylsphingosine; N-C12:0-NBD-beta-D-Lactosylsphingosine; N-C12:0-NBD-Lactosylceramide
• IUPAC Name: N-[(E,2S,3R)-1-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyoctadec-4-en-2-yl]-12-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]dodecanamide
• Molecular Weight: 984.00
• Molecular Formula: C48H81N5O16
• SMILES: CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O)O)NC(=O)CCCCCCCCCCCNC3=CC=C(C4=NON=C34)[N+](=O)[O-])O
• InChI: BMEDTTDNSALUFC-OXMKHARGSA-N
• InChI Key: InChI=1S/C48H81N5O16/c1-2-3-4-5-6-7-8-9-10-12-15-18-21-24-35(56)33(31-65-47-45(62)43(60)46(37(30-55)67-47)68-48-44(61)42(59)41(58)36(29-54)66-48)50-38(57)25-22-19-16-13-11-14-17-20-23-28-49-32-26-27-34(53(63)64)40-39(32)51-69-52-40/h21,24,26-27,33,35-37,41-49,54-56,58-62H,2-20,22-23,25,28-31H2,1H3,(H,50,57)/b24-21+/t33-,35+,36+,37+,41-,42-,43+,44+,45+,46+,47+,48-/m0/s1
• Purity: >98%
• Density: 1.30±0.1 g/cm3(Predicted)
• Solubility: Chloroform/methanol, 2:1
• Appearance: Solid
• Exact Mass: 983.568
• Hazards: No
• Hygroscopic: Yes
• Light Sensitive: Yes
• Percent Composition: C 58.58%, H 8.30%, N 7.12%, O 26.01%
• pKa: 12.79±0.70(Predicted)
• Shipping: No dry Ice
• Stability: 1 Year
• Storage Temperature: -20 °C