methyl O-(2-acetamido-3,6-di-O-benzyl-2-deoxy-β-D-galactopyranosyl)-(1->4)-(3-O-benzyl-α-L-idopyranosyluronic acid)-(1->3)-2-acetamido-6-O-benzyl-2-deoxy-β-D-galactopyranoside | 445397-84-2

分子结构分类

有机化合物 - 有机氧化合物

中文名称

——

中文别名

——

英文名称

methyl O-(2-acetamido-3,6-di-O-benzyl-2-deoxy-β-D-galactopyranosyl)-(1->4)-(3-O-benzyl-α-L-idopyranosyluronic acid)-(1->3)-2-acetamido-6-O-benzyl-2-deoxy-β-D-galactopyranoside

英文别名

——

methyl O-(2-acetamido-3,6-di-O-benzyl-2-deoxy-β-D-galactopyranosyl)-(1->4)-(3-O-benzyl-α-L-idopyranosyluronic acid)-(1->3)-2-acetamido-6-O-benzyl-2-deoxy-β-D-galactopyranoside化学式

CAS

445397-84-2

化学式

C₅₁H₆₂N₂O₁₇

mdl

——

分子量

975.056

InChiKey

PNWLCFAKBMXKFC-IQZOAJKASA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

2.36
重原子数：

70.0
可旋转键数：

22.0
环数：

7.0
sp3杂化的碳原子比例：

0.47
拓扑面积：

248.49
氢给体数：

6.0
氢受体数：

16.0

上下游信息

上游原料

中文名称	英文名称	CAS号	化学式	分子量
——	methyl O-(2-acetamido-3,6-di-O-benzyl-2-deoxy-β-D-galactopyranosyl)-(1->4)-(3-O-benzyl-α-L-idopyranosyluronic acid)-(1->3)-2-acetamido-6-O-benzyl-2-deoxy-4-O-pivaloyl-β-D-galactopyranoside	445397-83-1	C₅₆H₇₀N₂O₁₈	1059.17
——	methyl O-(2-acetamido-4-O-acetyl-3,6-di-O-benzyl-2-deoxy-β-D-galactopyranosyl)-(1->4)-(methyl 2-O-benzoyl-3-O-benzyl-α-L-idopyranosyluronate)-(1->3)-2-acetamido-4-O-acetyl-6-O-benzyl-2-deoxy-β-D-galactopyranoside	445397-82-0	C₆₃H₇₂N₂O₂₀	1177.27
——	methyl O-(2-acetamido-4-O-acetyl-3,6-di-O-benzyl-2-deoxy-β-D-galactopyranosyl)-(1->4)-(methyl 2-O-benzoyl-3-O-benzyl-α-L-idopyranosyluronate)-(1->3)-2-acetamido-6-O-benzyl-2-deoxy-4-O-pivaloyl-β-D-galactopyranoside	445397-81-9	C₆₆H₇₈N₂O₂₀	1219.35
——	methyl O-(4-O-acetyl-3,6-di-O-benzyl-2-deoxy-2-trichloroacetamido-β-D-galactopyranosyl)-(1->4)-(methyl 2-O-benzoyl-3-O-benzyl-α-L-idopyranosyluronate)-(1->3)-4-O-acetyl-6-O-benzyl-2-deoxy-2-trichloroacetamido-β-D-galactopyranoside	445397-80-8	C₆₃H₆₆Cl₆N₂O₂₀	1383.94
——	methyl O-(4-O-acetyl-3,6-di-O-benzyl-2-deoxy-2-trichloroacetamido-β-D-galactopyranosyl)-(1->4)-(methyl 2-O-benzoyl-3-O-benzyl-α-L-idopyranosyluronate)-(1->3)-6-O-benzyl-2-deoxy-4-O-pivaloyl-2-trichloroacetamido-β-D-galactopyranoside	445397-79-5	C₆₆H₇₂Cl₆N₂O₂₀	1426.02
——	methyl (methyl 2-O-benzoyl-3-O-benzyl-α-L-idopyranosyluronate)-(1->3)-4-O-acetyl-6-O-benzyl-2-deoxy-2-trichloroacetamido-β-D-galactopyranoside	445397-70-6	C₃₉H₄₂Cl₃NO₁₄	855.12
——	methyl (methyl 2-O-benzoyl-3-O-benzyl-α-L-idopyranosyluronate)-(1->3)-6-O-benzyl-2-deoxy-4-O-pivaloyl-2-trichloroacetamido-β-D-galactopyranoside	445397-69-3	C₄₂H₄₈Cl₃NO₁₄	897.2
——	(methyl 2-O-benzoyl-3-O-benzyl-4-O-chloroacetyl-α-L-idopyranosyluronate)-(1->3)-4-O-acetyl-6-O-benzyl-2-deoxy-2-trichloroacetamido-1-O-trichloroacetamidoyl-α-D-galactopyranoside	445397-68-2	C₄₂H₄₁Cl₇N₂O₁₅	1061.96
——	(methyl 2-O-benzoyl-3-O-benzyl-4-O-chloroacetyl-α-L-idopyranosyluronate)-(1->3)-6-O-benzyl-2-deoxy-4-O-pivaloyl-2-trichloroacetamido-1-O-trichloroacetamidoyl-α-D-galactopyranoside	445397-67-1	C₄₅H₄₇Cl₇N₂O₁₅	1104.04
——	4-methoxyphenyl O-(methyl 2-O-benzoyl-3-O-benzyl-α-L-idopyranosyluronate)-(1->3)-4-O-acetyl-6-O-benzyl-2-deoxy-2-trichloroacetamido-β-D-galactopyranoside	445397-65-9	C₄₅H₄₆Cl₃NO₁₅	947.217