(2S,3S,4S,5R,6S)-6-[6-[(3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxybenzo[a]pyren-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

• 常用名: (2S,3S,4S,5R,6S)-6-[6-[(3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxybenzo[a]pyren-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
• 英文名: (2S,3S,4S,5R,6S)-6-[6-[(3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxybenzo[a]pyren-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
• CAS号: 97287-75-7
• 分子量: 636.55600
• 密度: N/A
• 沸点: N/A
• 分子式: C₃₂H₂₈O₁₄
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: (2S,3S,4S,5R,6S)-6-[6-[(3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxybenzo[a]pyren-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

物理化学性质

• 分子式: C₃₂H₂₈O₁₄
• 分子量: 636.55600
• 精确质量: 636.14800
• PSA: 232.90000
• LogP: 0.27920
• InChIKey: XJZJSOOVGHURSS-MOMWAVNLSA-N
• SMILES: O=C(O)C1OC(Oc2ccc3ccc4c5ccccc5c(OC5OC(C(=O)O)C(O)C(O)C5O)c5ccc2c3c54)C(O)C(O)C1O

英文别名

• BP-3,6-Quinol-dgl
• Benzo(a)pyrene-3,6-quinol diglucuronide