[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯
概要:[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯(CAS 101843-86-1)是一种化学化合物,分子式为C48H78O18,分子量为942.52 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务,支持克级到吨级规格。
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯
[(3R,4S,5R,6S)-4-hydroxy-6-[[(3R,9R,12S,14R,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] acetate
又称:Astrasieversianin XI, Asn-XI, Astrasieversianin, Dodecanoic acid,sulfophenyl ester, [(3R,4S,5R,6S)-4-hydroxy-6-[[(3R,9R,12S,14R,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] acetate
| 分子式 | C48H78O18 |
|---|---|
| 分子量 | 942.52 g/mol |
| LogP | 0.8 |
| 拓扑极性表面积 | 273.0 Ų |
| 氢键供体数 | 9 |
| 氢键受体数 | 18 |
| 可旋转键数 | 10 |
| 精确质量 | 942.5188 |
| 重原子数 | 66 |
| 复杂度 | 1820.0 |
化学标识符
| CAS 编号 | 101843-86-1 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](CO[C@H]2OC3CC[C@]45CC46CC[C@@]7([C@H]([C@@H](C[C@]7(C6C[C@H](C5C3(C)C)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O)O)C)O)[C@]9(CC[C@H](O9)C(C)(C)O)C)C)OC(=O)C)O)O)O)O |
| InChIKey | ANUFIKIFSCIVQK-YUGLHUJHSA-N |
📋 应用领域
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯主要应用于有机合成与工艺化学。在实验室中常作为通用有机合成砌块使用。科弘生物供应[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯(CAS 101843-86-1),提供毫克级到公斤级定制合成,随货提供COA、MSDS及HPLC/NMR/MS分析报告。
产品概述
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯(CAS 101843-86-1)是一种精细化学品,分子式为C48H78O18,分子量 942.52 g/mol。 该化合物又名Astrasieversianin XI、Asn-XI。
科弘生物提供目录供应与定制合成(毫克至吨级),支持HPLC/NMR/MS全套检测,随货附COA与MSDS。请告知所需数量与纯度,获取报价与货期。
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯化学性质概览
属性洞察:[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的XLogP值为0.8,表明具有中等亲脂性,在水溶性和膜透过性之间取得平衡。 TPSA为273.0 Ų,极性较高,提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则,[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯有9个氢键供体和18个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的CAS号是多少?
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的CAS号为101843-86-1。
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的分子式是什么?
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的分子式为C48H78O18。
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的分子量是多少?
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的分子量为942.52 g/mol。
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯有哪些应用?
[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基]...
在哪里可以购买[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯?
您可以直接向科弘生物询价[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯的定制合成服务?
是的,科弘生物提供[(3R,4S,5R,6S)-4-羟基-6-[[(3R,9R,12S,14R,15R,16R)-14-羟基-15-[(2R,5S)-5-(2-羟基异丙基)-2-甲基氧代环戊烷-2-基]-7,7,12,16-四甲基-9-[(2S,3R,4S,5R)-3,4,5-三羟基噁烷-2-基]氧代-6-五环[9.7.0.01,3.03,8.012,16]十八烷基]氧代]-5-[(2S,3R,4R,5R,6S)-3,4,5-三羟基-6-甲基噁烷-2-基]氧代氧杂-3-基] 乙酸酯及相关化合物的定制合成服务。请联系我们并告知您的具体需求,包括数量、纯度和交期。