(2R,3S,4S,5S,6S)-2-(((2R,3R,4S,5S,6R)-2-hydroxy-5-(((2R,3R,4R,5S,6R)-5-hydroxy-4-(((2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2R,3R,4R,5S)-3,4,5-trihydroxyte trahydro-2H-pyran-2-yl)oxy)-6-((((2R,3R,4S,5S)-3,4,5-tr ihydroxytetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-6-(hydroxymethyl)-4-(((2S,3S,4S,5S)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)oxy)-6-methyltetrahy dro-2H-pyran-3,4,5-triol

• ChemBase编号: 184566
• 分子式: C39H66O32
• 平均质量: 1046.92214
• 单一同位素质量: 1046.35371995
• SMILES: C1(C(OC2C(C(C(C(O2)CO)O)O)O)C(C(OC1OC1C(C(OC2C(C(C(C(O2)C)O)O)O)C(OC1CO)O)OC1C(C(C(CO1)O)O)O)COC1C(C(C(CO1)O)O)O)O)OC1C(C(C(CO1)O)O)O
• Canonical SMILES: OCC1OC(O)C(C(C1OC1OC(COC2OCC(C(C2O)O)O)C(C(C1OC1OCC(C(C1O)O)O)OC1OC(CO)C(C(C1O)O)O)O)OC1OCC(C(C1O)O)O)OC1OC(C)C(C(C1O)O)O
• InChI: InChI=1S/C39H66O32/c1-8-15(45)21(51)26(56)37(63-8)70-31-30(69-35-24(54)17(47)10(43)5-60-35)28(13(3-41)64-33(31)58)67-39-32(71-36-25(55)18(48)11(44)6-61-36)29(68-38-27(57)22(52)19(49)12(2-40)65-38)20(50)14(66-39)7-62-34-23(53)16(46)9(42)4-59-34/h8-58H,2-7H2,1H3
• InChIKey: NMLOPXSNELFOLK-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (2R,3S,4S,5S,6S)-2-(((2R,3R,4S,5S,6R)-2-hydroxy-5-(((2R,3R,4R,5S,6R)-5-hydroxy-4-(((2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2R,3R,4R,5S)-3,4,5-trihydroxyte trahydro-2H-pyran-2-yl)oxy)-6-((((2R,3R,4S,5S)-3,4,5-tr ihydroxytetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-6-(hydroxymethyl)-4-(((2S,3S,4S,5S)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)oxy)-6-methyltetrahy dro-2H-pyran-3,4,5-triol
• IUPAC传统名: (2R,3S,4S,5S,6S)-2-(((2R,3R,4S,5S,6R)-2-hydroxy-5-(((2R,3R,4R,5S,6R)-5-hydroxy-4-(((2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2R,3R,4R,5S)-3,4,5-trihydroxyte trahydro-2H-pyran-2-yl)oxy)-6-((((2R,3R,4S,5S)-3,4,5-tr ihydroxytetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-6-(hydroxymethyl)-4-(((2S,3S,4S,5S)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)oxy)-6-methyltetrahy dro-2H-pyran-3,4,5-triol

登记号

• PubChem SID: 164240476
• PubChem CID: 5233069

理论计算性质

• 里宾斯基五规则: false

分子性质

产品相关信息

• 简要说明: Polymer, n=52-53
• 分类: Rare Genuine Natural Compounds