Marthasteroside A1
概要：Marthasteroside A1（CAS 89383-05-1）是一种化学化合物，分子式为C62H102O31S，分子量为1374.61 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。
[(3S,6S,10R,13R,17R)-6-[4-[5-[3-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-17-[(2R)-6-methyl-4-oxoheptan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate
又称：Marthasteroside A1, 3,3-Dimethyl-azetidin,Hydrochlorid, [(3S,6S,10R,13R,17R)-6-[4-[5-[3-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-17-[(2R)-6-methyl-4-oxoheptan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate, ((3S,6S,10R,13R,17R)-6-(4-(5-(3-(3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl)oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-4-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl)oxy-3,5-dihydroxy-6-methyloxan-2-yl)oxy-10,13-dimethyl-17-((2R)-6-methyl-4-oxoheptan-2-yl)-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta(a)phenanthren-3-yl) hydrogen sulfate, (9xi,14xi)-6alpha-{[6-Deoxyhexopyranosyl-(1->2)-[6-deoxyhexopyranosyl-(1->3)-6-deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->4)]pentopyranosyl-(1->3)-6-deoxyhexopyranosyl]oxy}-23-oxocholest-7-en-3beta-yl hydrogen sulfate
| 分子式 | C62H102O31S |
|---|---|
| 分子量 | 1374.61 g/mol |
| LogP | -2.9397 |
| 拓扑极性表面积 | 474.65 Ų |
| 氢键供体数 | 15 |
| 氢键受体数 | 30 |
| 可旋转键数 | 20 |
| 精确质量 | 1374.6125 |
| 重原子数 | 94 |
| 复杂度 | 2681.111 |
化学标识符
| CAS 编号 | 89383-05-1 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2C(C(OC(C2O)OC3C(C(C(OC3OC4COC(C(C4O)OC5C(C(C(C(O5)C)O)O)O)OC6C(C(OC(C6O)O[C@H]7C=C8C9CC[C@@H]([C@]9(CCC8[C@@]1(C7C[C@H](CC1)OS(=O)(=O)O)C)C)[C@H](C)CC(=O)CC(C)C)C)O)CO)O)O)C)O)O)O)O |
产品概述
Marthasteroside A1（CAS 89383-05-1），分子式为C62H102O31S，分子量为1374.61 g/mol。IUPAC名：[(3S,6S,10R,13R,17R)-6-[4-[5-[3-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-17-[(2R)-6-methyl-4-oxoheptan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate。
Marthasteroside A1化学性质概览
属性洞察：Marthasteroside A1
Marthasteroside A1的XLogP值为-2.9397，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474.65 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，Marthasteroside A1有15个氢键供体和30个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
Marthasteroside A1的CAS号是多少？
Marthasteroside A1的CAS号为89383-05-1。
Marthasteroside A1的分子式是什么？
Marthasteroside A1的分子式为C62H102O31S。
Marthasteroside A1的分子量是多少？
Marthasteroside A1的分子量为1374.61 g/mol。
在哪里可以购买Marthasteroside A1？
您可以直接向科弘生物询价Marthasteroside A1。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Marthasteroside A1的定制合成服务？
是的，科弘生物提供Marthasteroside A1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。