2-Butan-2-yl-21',24'-dihydroxy-12'-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one

2-Butan-2-yl-21',24'-dihydroxy-12'-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one · CAS 71831-09-9

中文名: 暂无
中文别名: 暂无
英文名: 2-Butan-2-yl-21',24'-dihydroxy-12'-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one
CAS: 71831-09-9
CID: 73152347
IUPAC 名称: 2-butan-2-yl-21',24'-dihydroxy-12'-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one

名称与编号

中文名: 暂无
中文别名: 暂无
英文名: 2-Butan-2-yl-21',24'-dihydroxy-12'-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one
CAS: 71831-09-9
CID: 73152347
IUPAC 名称: 2-butan-2-yl-21',24'-dihydroxy-12'-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one

分子属性

分子式: C41H60O11
分子量: 728.9 g/mol
精确质量: 728.41356273 Da
单同位素质量: 728.41356273 Da
XLogP: 3.4
极性表面积: 142 Å²
氢键供体: 3
氢键受体: 11
可旋转键: 5
重原子数: 52
净电荷: 0
结构复杂度: 1450

结构标识

InChIKey: ZBVWYDMYMRLKIV-UHFFFAOYSA-N
SMILES: CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)O)OC)C)C
InChI: InChI=1S/C41H60O11/c1-9-22(2)37-25(5)15-16-40(52-37)20-30-18-29(51-40)14-13-24(4)36(50-33-19-32(46-8)35(43)27(7)48-33)23(3)11-10-12-28-21-47-38-34(42)26(6)17-31(39(44)49-30)41(28,38)45/h10-13,15-17,22-23,25,27,29-38,42-43,45H,9,14,18-21H2,1-8H3