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7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid, 4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-a-hydroxy-4a,7,9,9-tetramethyl-2,10,13-trioxo-,methyl ester (9CI) | 25570-77-8

7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid, 4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-a-hydroxy-4a,7,9,9-tetramethyl-2,10,13-trioxo-,methyl ester (9CI)结构式图片|25570-77-8结构式图片
7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid, 4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-a-hydroxy-4a,7,9,9-tetramethyl-2,10,13-trioxo-,methyl ester (9CI)
25570-77-8
C27H32O8
484.538188934326
名称和标识符
InChIKey QEQSVLPPAOTREQ-UHFFFAOYSA-N
Inchi 1S/C27H32O8/c1-25(2)20(19(29)24(32)33-5)27(4)16-6-8-26(3)17(14(16)10-15(21(25)30)22(27)31)11-18(28)35-23(26)13-7-9-34-12-13/h7,9,11-12,14-16,19-20,23,29H,6,8,10H2,1-5H3
SMILES O=C1C2([H])C(C(C([H])([H])[H])(C([H])([H])[H])C([H])(C([H])(C(=O)OC([H])([H])[H])O[H])C1(C([H])([H])[H])C1([H])C([H])([H])C([H])([H])C3(C([H])([H])[H])C([H])(C4=C([H])OC([H])=C4[H])OC(C([H])=C3C1([H])C2([H])[H])=O)=O
别名信息
- 中文别名 -
- 英文别名 -
  • 7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid, 4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-a-hydroxy-4a,7,9,9-tetramethyl-2,10,13-trioxo-,methyl ester (9CI)
  • 4-(3-Furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-α-hydroxy-4a,7,9,9-tetramethyl-2,10,13-trioxo-7,11-methano-2H-cycloocta[f][2]benzopyran-8-acetic acid methyl ester
  • 7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid, 4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-a-hydroxy-4a
  • 7,11-Methano-2H-cycloocta[f][2]benzopyran-8-glycolicacid, 4b-(3-furyl)-4,4a,5,6,6ab,7,8a,9,10,11,12,12ab-dodecahydro-4ab,7,9,9-tetramethyl-2,10,13-trioxo-, methyl ester, (+)-(8CI)
  • Carapin, 6-hydroxy-
  • 6-Hydroxycarapin
  • 7,11-Methano-2H-cycloocta[f][2]benzopyran-8-acetic acid, 4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-α-hydroxy-4a,7,9,9-tetramethyl-2,10,13-trioxo-, methyl ester (9CI)
物化性质
实验特性
沸点 655.8±55.0 °C(Predicted)
酸度系数(pKa) 9.37±0.70(Predicted)
密度 1.32±0.1 g/cm3(Predicted)
计算特性
精确分子量 484.21
氢键供体数量 1
氢键受体数量 8
可旋转化学键数量 4
同位素质量 484.21
重原子数量 35
复杂度 1010
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 8
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
拓扑分子极性表面积 120A^2
960化工网为您提供7,11-Methano-2H-cycloocta[f][2]benzopyran-8-aceticacid, 4-(3-furanyl)-4,4a,5,6,6a,7,8,9,10,11,12,12a-dodecahydro-a-hydroxy-4a,7,9,9-tetramethyl-2,10,13-trioxo-,methyl ester (9CI)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.:25570-77-8,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:25570-77-8
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