(2S)-1-[(2E)-2-[(2S)-2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene]ethylidene]-5-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxy-2,3-dihydroindol-1-ium-2-carboxylate

• 常用名: (2S)-1-[(2E)-2-[(2S)-2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene]ethylidene]-5-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxy-2,3-dihydroindol-1-ium-2-carboxylate
• 英文名: (2S)-1-[(2E)-2-[(2S)-2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene]ethylidene]-5-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxy-2,3-dihydroindol-1-ium-2-carboxylate
• CAS号: 16955-52-5
• 分子量: 726.63800
• 密度: N/A
• 沸点: N/A
• 分子式: C₃₄H₃₄N₂O₁₆
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: (2S)-1-[(2E)-2-[(2S)-2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene]ethylidene]-5-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxy-2,3-dihydroindol-1-ium-2-carboxylate

物理化学性质

• 分子式: C₃₄H₃₄N₂O₁₆
• 分子量: 726.63800
• 精确质量: 726.19100
• PSA: 284.91000
• LogP: 0.34070
• InChIKey: PZVSGHKONASTEC-WPUGSIMNSA-N
• SMILES: COc1cc(C=CC(=O)OCC2OC(Oc3cc4c(cc3O)CC(C(=O)[O-])[N+]4=CC=C3C=C(C(=O)O)NC(C(=O)O)C3)C(O)C(O)C2O)ccc1O

英文别名

• Gomphrenin-V