[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methyl-2-oxochromen-7-yl)oxy-2-(trityloxymethyl)oxan-3-yl] acetate的二维分子结构

[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methyl-2-oxochromen-7-yl)oxy-2-(trityloxymethyl)oxan-3-yl] acetate

[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methyl-2-oxochromen-7-yl)oxy-2-(trityloxymethyl)oxan-3-yl] acetate · CAS 937018-35-4

中文名
暂无
中文别名
暂无
英文名
[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methyl-2-oxochromen-7-yl)oxy-2-(trityloxymethyl)oxan-3-yl] acetate
CAS
937018-35-4
CID
16126094
IUPAC 名称
[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methyl-2-oxochromen-7-yl)oxy-2-(trityloxymethyl)oxan-3-yl] acetate

名称与编号

中文名
暂无
中文别名
暂无
英文名
[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methyl-2-oxochromen-7-yl)oxy-2-(trityloxymethyl)oxan-3-yl] acetate
CAS
937018-35-4
CID
16126094
IUPAC 名称
[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-methyl-2-oxochromen-7-yl)oxy-2-(trityloxymethyl)oxan-3-yl] acetate

分子属性

分子式
C41H38O11
分子量
706.7 g/mol
精确质量
706.24141202 Da
单同位素质量
706.24141202 Da
XLogP
5.6
极性表面积
133 Ų
氢键供体
0
氢键受体
11
可旋转键
14
重原子数
52
净电荷
0
结构复杂度
1230

结构标识

InChIKey
UHSAODFMAFXSFG-HRSAFRLBSA-N
SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)OC(=O)C)OC(=O)C)OC(=O)C
InChI
InChI=1S/C41H38O11/c1-25-22-36(45)51-34-23-32(20-21-33(25)34)50-40-39(49-28(4)44)38(48-27(3)43)37(47-26(2)42)35(52-40)24-46-41(29-14-8-5-9-15-29,30-16-10-6-11-17-30)31-18-12-7-13-19-31/h5-23,35,37-40H,24H2,1-4H3/t35-,37-,38+,39-,40-/m1/s1

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