(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one
概要:(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one(CAS 52557-29-6)是一种化学化合物,分子式为C20H28O6,分子量为364.19 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。
(1S,4S,5R,6R,9S,14R)-4,5,6-trihydroxy-7,11-bis(hydroxymethyl)-3,11,14-trimethyltetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dien-15-one
又称:(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one, 5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one
| 分子式 | C20H28O6 |
|---|---|
| 分子量 | 364.19 g/mol |
| LogP | -0.2124 |
| 拓扑极性表面积 | 118.22 Ų |
| 氢键供体数 | 5 |
| 氢键受体数 | 6 |
| 可旋转键数 | 2 |
| 精确质量 | 364.1886 |
| 重原子数 | 26 |
| 复杂度 | 727.81305 |
化学标识符
| CAS 编号 | 52557-29-6 |
|---|---|
| SMILES | C[C@@H]1CC2C(C2(C)CO)[C@@H]3C=C([C@H]([C@]4([C@@]1(C3=O)C=C([C@@H]4O)C)O)O)CO |
产品概述
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one(CAS 52557-29-6),分子式为C20H28O6,分子量为364.19 g/mol。IUPAC名:(1S,4S,5R,6R,9S,14R)-4,5,6-trihydroxy-7,11-bis(hydroxymethyl)-3,11,14-trimethyltetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dien-15-one。
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one化学性质概览
属性洞察:(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的XLogP值为-0.2124,表明该化合物具有亲水性(水溶性好),适合水性配方和生物检测应用。 TPSA为118.22 Ų,处于中等极性范围,在透过性和溶解性之间取得平衡。 根据Lipinski五规则,(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one有5个氢键供体和6个氢键受体,均在类药范围内,提示具有较好的口服生物利用度潜力。
常见问题
常见问题
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的CAS号是多少?
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的CAS号为52557-29-6。
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的分子式是什么?
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的分子式为C20H28O6。
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的分子量是多少?
(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的分子量为364.19 g/mol。
在哪里可以购买(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one?
您可以直接向科弘生物询价(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one。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(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one的定制合成服务?
是的,科弘生物提供(2S,5R,5aR,6S,8aS,9R)-5,5a,6-Trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one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。