3-O-sulfo-beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-3-O-sulfo-D-galacto-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranose

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-O-sulfo-beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->4)-3-O-sulfo-D-galacto-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranose
• 英文别名: [(2R,3S,4R,5R)-3-[(2S,3R,4R,5R,6R)-3-acetamido-4-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-sulfooxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl] hydrogen sulfate
• 化学式: C₂₆H₄₅NO₂₇S₂
• 分子量: 867.8
• InChiKey: QQBJQVWNXPDNQN-KIEOIEQOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -9.2
• 重原子数：
  56
• 可旋转键数：
  15
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.96
• 拓扑面积：
  460
• 氢给体数：
  14
• 氢受体数：
  27