4-O-<(8'S)-7'-N,6'-O-carbonyl-2',3',7'-trideoxy-8'-O-methyl-7'-(methylamino)-2'-(tosylamino)-D-glycero-α-D-allo-octodialdo-1',5':8',4'-dipyranos-1'-yl>-5,6-O-cyclohexylidene-1,3-di-N-tosyl-2-deoxystreptamine | 88970-43-8

分子结构分类

有机化合物

中文名称

——

中文别名

——

英文名称

4-O-<(8'S)-7'-N,6'-O-carbonyl-2',3',7'-trideoxy-8'-O-methyl-7'-(methylamino)-2'-(tosylamino)-D-glycero-α-D-allo-octodialdo-1',5':8',4'-dipyranos-1'-yl>-5,6-O-cyclohexylidene-1,3-di-N-tosyl-2-deoxystreptamine

英文别名

4-O-[(8'S)-7'-N,6'-O-carbonyl-2',3',7'-trideoxy-8'-O-methyl-7'-(methylamino)-2'-(tosylamino)-D-glycero-α-D-allo-octodialdo-1',5':8',4'-dipyranos-1'-yl]-5,6-O-cyclohexylidene-1,3-di-N-tosyl-2-deoxystreptamine；N-[(3aS,4R,6S,7R,7aS)-7-[[(1S,2R,6S,7S,9S,11R,12S)-7-methoxy-5-methyl-11-[(4-methylphenyl)sulfonylamino]-4-oxo-3,8,13-trioxa-5-azatricyclo[7.4.0.02,6]tridecan-12-yl]oxy]-6-[(4-methylphenyl)sulfonylamino]spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]-4-yl]-4-methylbenzenesulfonamide

CAS

88970-43-8

化学式

C₄₄H₅₆N₄O₁₄S₃

mdl

——

分子量

961.145

InChiKey

FZXUUILTOPSLRY-KMAIUHRMSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

3.49
重原子数：

65.0
可旋转键数：

12.0
环数：

9.0
sp3杂化的碳原子比例：

0.57
拓扑面积：

223.43
氢给体数：

3.0
氢受体数：

14.0

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
——	4-O-<(8'S)-7'--2',7'-dideoxy-8'-O-methyl-2'-(tosylamino)-D-threo-α-D-gluco-octodialdo-1',5':8',4'-dipyranos-1'-yl>-5,6-O-cyclohexylidene-1,3-di-N-tosyl-2-deoxystreptamine	88970-39-2	C₅₁H₆₄N₄O₁₆S₃	1085.28
——	N-[(3aS,4R,6S,7R,7aS)-7-[(3aR,4R,6R,7R,7aR)-4-[(dimethylamino)methyl]-7-[(4-methylphenyl)sulfonylamino]spiro[4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-2,1'-cyclohexane]-6-yl]oxy-6-[(4-methylphenyl)sulfonylamino]spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]-4-yl]-4-methylbenzenesulfonamide	91613-41-1	C₄₇H₆₄N₄O₁₂S₃	973.243
——	6'-N-(benzyloxycarbonyl)-3',4':5,6-di-O-cyclohexylidene-1,2',3-tri-N-tosylneamine	88985-60-8	C₅₃H₆₆N₄O₁₄S₃	1079.32
——	4-O-<(8'S)-7'--2',7'-dideoxy-3',6'-di-O-mesyl-8'-O-methyl-2'-(tosylamino)-D-threo-α-D-gluco-octodialdo-1',5':8',4'-dipyranos-1'-yl>-5,6-O-cyclohexylidene-1,3-di-N-tosyl-2-deoxystreptamine	88970-40-5	C₅₃H₆₈N₄O₂₀S₅	1241.47
——	(2R,4S,6S,7R,8R,8aS)-6-(((3aS,4R,6S,7R,7aS)-4,6-bis((4-methylphenyl)sulfonamido)hexahydrospiro[benzo[d][1,3]dioxole-2,1'-cyclohexan]-7-yl)oxy)-2,8-dihydroxy-7-((4-methylphenyl)sulfonamido)octahydropyrano[3,2-b]pyran-4-yl acetate	88970-36-9	C₄₃H₅₅N₃O₁₅S₃	950.119
——	1-N-acetyl-4-O-<-3',6'-di-O-acetyl-4',8'-anhydro-2',7'-dideoxy-2'-(tosylamino)-D-glycero-α-D-gluco-oct-7'-enopyranos-1'-yl>-5,6-O-cyclohexylidene-1,3-di-N-tosyl-2-deoxystreptamine	88970-34-7	C₄₇H₅₇N₃O₁₆S₃	1016.18

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	methyl β-apsosaminide	58068-66-9	C₁₆H₃₂N₄