Astrasieversianin XVI
概要:Astrasieversianin XVI(CAS 101843-82-7)是一种化学化合物,分子式为C47H78O18,分子量为930.52 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。
(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-4,5-dihydroxy-2-[[(1S,3R,6S,8R,9S,11S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
又称:Astrasieversianin XVI, J2.767.384H, (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-4,5-dihydroxy-2-[[(1S,3R,6S,8R,9S,11S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol, ((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl) (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-((2R,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl)oxy-tetrahydropyran-2-yl)oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate, (20R,24S)-3beta-{[2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-xylopyranosyl]oxy}-16beta,25-dihydroxy-9beta-20,24-epoxy-9,19-cyclolanostan-6alpha-yl beta-D-glucopyranoside
| 分子式 | C47H78O18 |
|---|---|
| 分子量 | 930.52 g/mol |
| LogP | 0.2 |
| 拓扑极性表面积 | 287.0 Ų |
| 氢键供体数 | 11 |
| 氢键受体数 | 18 |
| 可旋转键数 | 9 |
| 精确质量 | 930.5188 |
| 重原子数 | 65 |
| 复杂度 | 1760.0 |
化学标识符
| CAS 编号 | 101843-82-7 |
|---|---|
| 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]2O[C@H]3CC[C@]45C[C@]46CC[C@@]7([C@H]([C@H](C[C@]7([C@@H]6C[C@@H]([C@H]5C3(C)C)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)O)[C@]9(CC[C@H](O9)C(C)(C)O)C)C)O)O)O)O)O |
| InChIKey | OHYHOQFXLXSVIP-SOMZREBESA-N |
产品概述
Astrasieversianin XVI(CAS 101843-82-7),分子式为C47H78O18,分子量为930.52 g/mol。IUPAC名:(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-4,5-dihydroxy-2-[[(1S,3R,6S,8R,9S,11S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol。
Astrasieversianin XVI化学性质概览
属性洞察:Astrasieversianin XVI
Astrasieversianin XVI的XLogP值为0.2,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287.0 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,Astrasieversianin XVI有11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
Astrasieversianin XVI的CAS号是多少?
Astrasieversianin XVI的CAS号为101843-82-7。
Astrasieversianin XVI的分子式是什么?
Astrasieversianin XVI的分子式为C47H78O18。
Astrasieversianin XVI的分子量是多少?
Astrasieversianin XVI的分子量为930.52 g/mol。
在哪里可以购买Astrasieversianin XVI?
您可以直接向科弘生物询价Astrasieversianin XVI。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
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