8-(4-Phenyl[1,2,3]triazol-1-yl)octyl 2,3,4,6-Tetra-O-sulfo-alpha-D-mannopyranosyl-(1->3)-2,4,6-tri-O-sulfo-alpha-D-mannopyranosyl-(1->3)-2,4,6-tri-O-sulfo-alpha-D-mannopyranosyl-(1->3)-2,4,6-tri-O-sulfo-alpha-D-mannopyranosyl-(1->2)-3,4,6-tri-O-sulfo-alpha-D-mannopyranoside,Hexadecasodium Salt

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 8-(4-Phenyl[1,2,3]triazol-1-yl)octyl 2,3,4,6-Tetra-O-sulfo-alpha-D-mannopyranosyl-(1->3)-2,4,6-tri-O-sulfo-alpha-D-mannopyranosyl-(1->3)-2,4,6-tri-O-sulfo-alpha-D-mannopyranosyl-(1->3)-2,4,6-tri-O-sulfo-alpha-D-mannopyranosyl-(1->2)-3,4,6-tri-O-sulfo-alpha-D-mannopyranoside,Hexadecasodium Salt
• 英文别名: [(2R,3R,4R,5S,6S)-5-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-3,5-disulfonatooxy-6-(sulfonatooxymethyl)-4-[(2R,3S,4S,5R,6R)-3,4,5-trisulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5-disulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-3,5-disulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-[8-(4-phenyltriazol-1-yl)octoxy]-3,4-disulfonatooxyoxan-2-yl]methyl sulfate
• 化学式: C46H57N3O74S16-16
• 分子量: 2349.0
• InChiKey: PSNHLUHUOQZMFM-WMNBTXQWSA-A

计算性质

• 辛醇/水分配系数(LogP)：
  -15.1
• 重原子数：
  139
• 可旋转键数：
  40
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  1320
• 氢给体数：
  0
• 氢受体数：
  76