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b-D-吡喃葡萄糖苷,(1aR,2S,3aR,5R,5aR,5bS)-四氢-5-羟基-5b-[[(4-羟基-3-甲氧基苯甲酰基)氧基]甲基]-2-甲基-2,5-亚甲基-1H-3,4-二氧酰基环丁烷[cd]戊烯-1a(2H)-基 | 172705-25-8

b-D-吡喃葡萄糖苷,(1aR,2S,3aR,5R,5aR,5bS)-四氢-5-羟基-5b-[[(4-羟基-3-甲氧基苯甲酰基)氧基]甲基]-2-甲基-2,5-亚甲基-1H-3,4-二氧酰基环丁烷[cd]戊烯-1a(2H)-基结构式图片|172705-25-8结构式图片
b-D-吡喃葡萄糖苷,(1aR,2S,3aR,5R,5aR,5bS)-四氢-5-羟基-5b-[[(4-羟基-3-甲氧基苯甲酰基)氧基]甲基]-2-甲基-2,5-亚甲基-1H-3,4-二氧酰基环丁烷[cd]戊烯-1a(2H)-基
b-D-Glucopyranoside,(1aR,2S,3aR,5R,5aR,5bS)-tetrahydro-5-hydroxy-5b-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta[cd]pentalen-1a(2H)-yl
172705-25-8
C24H30O13
526.4872
86278277
名称和标识符
InChIKey VMBNWSNNKXQGBU-WQGKFXPUSA-N
Inchi InChI=1S/C24H30O13/c1-21-8-23(31)14-6-24(21,35-19-17(29)16(28)15(27)13(7-25)34-19)22(14,20(36-21)37-23)9-33-18(30)10-3-4-11(26)12(5-10)32-2/h3-5,13-17,19-20,25-29,31H,6-9H2,1-2H3/t13-,14-,15-,16+,17-,19+,20+,21?,22+,23?,24+/m1/s1
SMILES COC1=C(O)C=CC(C(OC[C@@]23[C@H]4C[C@@]2(C2(CC4(O)O[C@@H]3O2)C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=O)=C1
别名信息
- 中文别名 -
- 英文别名 -
  • b-D-Glucopyranoside,(1aR,2S,3aR,5R,5aR,5bS)-tetrahydro-5-hydroxy-5b-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta[cd]pentalen-1a(2H)-yl
  • b-D-Glucopyranoside,(1aR,2S,3aR,5R,5aR,5bS)-tetrahydro-5-hydroxy-5b-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]-2-methyl-2,5-me
  • b-D-Glucopyranoside,tetrahydro-5-hydroxy-5b-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta[cd]pentalen-1a(2H)-yl,[1aR-(1aa,2b,3aa,5a,5aa,5ba)]-
  • Mudanpioside E
  • .BETA.-D-GLUCOPYRANOSIDE, (1AR,2S,3AR,5R,5AR,5BS)-TETRAHYDRO-5-HYDROXY-5B-(((4-HYDROXY-3-METHOXYBENZOYL)OXY)METHYL)-2-METHYL-2,5-METHANO-1H-3,4-DIOXACYCLOBUTA(CD)PENTALEN-1A(2H)-YL
  • 172705-25-8
  • beta-D-Glucopyranoside, (1aR,2S,3aR,5R,5aR,5bS)-tetrahydro-5-hydroxy-5b-(((4-hydroxy-3-methoxybenzoyl)oxy)methyl)-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta(cd)pentalen-1a(2H)-yl
  • mudanpioside E
  • Q27271462
  • UNII-923VYO8W98
  • 923VYO8W98
物化性质
计算特性
精确分子量 526.16864101g/mol
氢键供体数量 6
氢键受体数量 13
可旋转化学键数量 8
同位素质量 526.16864101g/mol
重原子数量 37
复杂度 934
同位素原子数量 0
确定原子立构中心数量 9
不确定原子立构中心数量 2
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) -1.4
拓扑分子极性表面积 194Ų
专业数据库参考
PubChemId 86278277
960化工网为您提供b-D-吡喃葡萄糖苷,(1aR,2S,3aR,5R,5aR,5bS)-四氢-5-羟基-5b-[[(4-羟基-3-甲氧基苯甲酰基)氧基]甲基]-2-甲基-2,5-亚甲基-1H-3,4-二氧酰基环丁烷[cd]戊烯-1a(2H)-基专业化合物百科信息,包括中文名,英文名,分子式,分子量,以及该化合物的CasNo.:172705-25-8,和相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等;| WAP 版:172705-25-8
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