(2R,3S,4R,5R)-2,3,4,5,6-Pentahydroxy-N-{3-[(9Z)-9-octadecen-1-ylamino]propyl}hexanamide
[CAS# 93980-74-6]

Identification

• Name: (2R,3S,4R,5R)-2,3,4,5,6-Pentahydroxy-N-{3-[(9Z)-9-octadecen-1-ylamino]propyl}hexanamide
• Synonyms: N-[3-((Z)-octadec-9-en-1-ylamino)propyl]-D-gluconamide
• Molecular Formula: C₂₇H₅₄N₂O₆
• Molecular Weight: 502.73
• CAS Registry Number: 93980-74-6
• EINECS: 301-054-0
• SMILES: O[C@H]([C@@H](O)C(=O)NCCCNCCCCCCCC/C=C\CCCCCCCC)[C@H](O)[C@H](O)CO
• InChI: 1S/C27H54N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-28-20-18-21-29-27(35)26(34)25(33)24(32)23(31)22-30/h9-10,23-26,28,30-34H,2-8,11-22H2,1H3,(H,29,35)/b10-9-/t23-,24-,25+,26-/m1/s1
• InChIKey: LCRAWTITTNMLAM-JMFVFQDWSA-N

Properties

• Density: 1.066g/cm³ (Cal.)
• Boiling point: 732.462°C at 760 mmHg (Cal.)
• Flash point: 396.779°C (Cal.)