N-[4,5-dihydroxy-2-phenylmethoxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide的二维分子结构

N-[4,5-dihydroxy-2-phenylmethoxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide

N-[4,5-dihydroxy-2-phenylmethoxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide · CAS 93496-44-7

中文名
暂无
中文别名
暂无
英文名
N-[4,5-dihydroxy-2-phenylmethoxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide
CAS
93496-44-7
CID
3543154
IUPAC 名称
N-[4,5-dihydroxy-2-phenylmethoxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide

名称与编号

中文名
暂无
中文别名
暂无
英文名
N-[4,5-dihydroxy-2-phenylmethoxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide
CAS
93496-44-7
CID
3543154
IUPAC 名称
N-[4,5-dihydroxy-2-phenylmethoxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamide

分子属性

分子式
C21H31NO11
分子量
473.5 g/mol
精确质量
473.1897108 Da
单同位素质量
473.1897108 Da
XLogP
-2.8
极性表面积
187 Ų
氢键供体
7
氢键受体
11
可旋转键
8
重原子数
33
净电荷
0
结构复杂度
619

结构标识

InChIKey
AJWSWORSAKFGER-UHFFFAOYSA-N
SMILES
CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)COC3C(C(C(C(O3)CO)O)O)O)O)O
InChI
InChI=1S/C21H31NO11/c1-10(24)22-14-17(27)16(26)13(33-20(14)30-8-11-5-3-2-4-6-11)9-31-21-19(29)18(28)15(25)12(7-23)32-21/h2-6,12-21,23,25-29H,7-9H2,1H3,(H,22,24)

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