Toluene-4-sulfonic acid (2R,3S,5R,6S)-3-[(2R,4aR,5aS,8R,9S,10aR,11aS)-9-allyl-2-(4-methoxy-phenyl)-decahydro-1,3,5,10-tetraoxa-cyclohepta[b]naphthalen-8-yloxy]-5-benzyloxy-6-benzyloxymethyl-tetrahydro-pyran-2-ylmethyl ester | 602301-94-0

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

Toluene-4-sulfonic acid (2R,3S,5R,6S)-3-[(2R,4aR,5aS,8R,9S,10aR,11aS)-9-allyl-2-(4-methoxy-phenyl)-decahydro-1,3,5,10-tetraoxa-cyclohepta[b]naphthalen-8-yloxy]-5-benzyloxy-6-benzyloxymethyl-tetrahydro-pyran-2-ylmethyl ester

英文别名

——

Toluene-4-sulfonic acid (2R,3S,5R,6S)-3-[(2R,4aR,5aS,8R,9S,10aR,11aS)-9-allyl-2-(4-methoxy-phenyl)-decahydro-1,3,5,10-tetraoxa-cyclohepta[b]naphthalen-8-yloxy]-5-benzyloxy-6-benzyloxymethyl-tetrahydro-pyran-2-ylmethyl ester化学式

CAS

602301-94-0

化学式

C₄₉H₅₈O₁₂S

mdl

——

分子量

871.058

InChiKey

SKCVNWZLIFPIQZ-SYYXQNQPSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

7.82
重原子数：

62.0
可旋转键数：

17.0
环数：

8.0
sp3杂化的碳原子比例：

0.47
拓扑面积：

126.44
氢给体数：

0.0
氢受体数：

12.0

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
——	(2R,4aR,5aS,8R,9S,10aR,11aS)-9-Allyl-8-[(2R,3S,5R,6S)-5-benzyloxy-6-benzyloxymethyl-2-(1-ethoxy-ethoxymethyl)-tetrahydro-pyran-3-yloxy]-2-(4-methoxy-phenyl)-decahydro-1,3,5,10-tetraoxa-cyclohepta[b]naphthalene	602301-88-2	C₄₆H₆₀O₁₁	788.976
——	2-[(2R,4aR,5aS,8R,9S,10aR,11aS)-8-[(2R,3S,5R,6S)-5-Benzyloxy-6-benzyloxymethyl-2-(1-ethoxy-ethoxymethyl)-tetrahydro-pyran-3-yloxy]-2-(4-methoxy-phenyl)-decahydro-1,3,5,10-tetraoxa-cyclohepta[b]naphthalen-9-yl]-ethanol	602301-82-6	C₄₅H₆₀O₁₂	792.964
——	(2R,4aR,6S,7R,8aS)-7-Benzyloxy-6-benzyloxymethyl-2-(4-methoxy-phenyl)-hexahydro-pyrano[3,2-d][1,3]dioxine	602301-75-7	C₂₉H₃₂O₆	476.569
——	(2R,4aR,6S,7R,8aS)-2-(4-Methoxy-phenyl)-6-vinyl-hexahydro-pyrano[3,2-d][1,3]dioxin-7-ol	602301-65-5	C₁₆H₂₀O₅	292.332
——	(2R,4aR,6S,7R,8aS)-6-Hydroxymethyl-2-(4-methoxy-phenyl)-hexahydro-pyrano[3,2-d][1,3]dioxin-7-ol	620949-24-8	C₁₅H₂₀O₆	296.32
——	[(2R,4aR,6S,7R,8aS)-6-Allyl-2-(4-methoxy-phenyl)-hexahydro-pyrano[3,2-d][1,3]dioxin-7-yloxy]-tert-butyl-dimethyl-silane	602301-79-1	C₂₃H₃₆O₅Si	420.621
——	tert-Butyl-[(2R,4aR,6S,7R,8aS)-2-(4-methoxy-phenyl)-6-vinyl-hexahydro-pyrano[3,2-d][1,3]dioxin-7-yloxy]-dimethyl-silane	602301-77-9	C₂₂H₃₄O₅Si	406.594
——	tert-Butyl-[(2R,4aR,6S,7R,8aS)-2-(4-methoxy-phenyl)-6-(3-phenylsulfanyl-propyl)-hexahydro-pyrano[3,2-d][1,3]dioxin-7-yloxy]-dimethyl-silane	474248-52-7	C₂₉H₄₂O₅SSi	530.801