Agavoside H
概要:Agavoside H(CAS 76689-28-6)是一种化学化合物,分子式为C68H112O37,分子量为1520.69 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。
16-[5-[5-[3-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-10-one
又称:Agavasaponin H, Agavoside H, Furostan-12-one, 3-((O-6-deoxy-alpha-L-mannopyranosyl-(1-4)-O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-(beta-D-xylopyranosyl-(1-2))-O-beta-D-glucopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-4)-beta-D-galactopyranosyl)oxy)-26-(beta-D-glucopyranosyloxy)-22-hydroxy-, (3-beta,5-alpha,22-alpha,25R)-, 16-[5-[5-[3-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-10-one
| 分子式 | C68H112O37 |
|---|---|
| 分子量 | 1520.69 g/mol |
| LogP | -8.6091 |
| 拓扑极性表面积 | 580.35 Ų |
| 氢键供体数 | 21 |
| 氢键受体数 | 37 |
| 可旋转键数 | 22 |
| 精确质量 | 1520.6882 |
| 重原子数 | 105 |
| 复杂度 | 2839.0447 |
化学标识符
| CAS 编号 | 76689-28-6 |
|---|---|
| SMILES | CC1C2C(CC3C2(C(=O)CC4C3CCC5C4(CCC(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)C)O)OC2C(C(C(C(O2)C)O)O)O)O)O)O)O)O)C)C)OC1(CCC(C)COC1C(C(C(C(O1)CO)O)O)O)O |
产品概述
Agavoside H(CAS 76689-28-6),分子式为C68H112O37,分子量为1520.69 g/mol。IUPAC名:16-[5-[5-[3-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-10-one。
Agavoside H化学性质概览
属性洞察:Agavoside H
Agavoside H的XLogP值为-8.6091,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580.35 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,Agavoside H有21个氢键供体和37个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
Agavoside H的CAS号是多少?
Agavoside H的CAS号为76689-28-6。
Agavoside H的分子式是什么?
Agavoside H的分子式为C68H112O37。
Agavoside H的分子量是多少?
Agavoside H的分子量为1520.69 g/mol。
在哪里可以购买Agavoside H?
您可以直接向科弘生物询价Agavoside H。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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