![[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate structure](/static/products/7534/753444-83-6.webp)
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate
概要：[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate（CAS 753444-83-6）是一种化学化合物，分子式为C35H62O13S，分子量为722.39 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,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(2R,5R)-5-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxyoxan-2-yl]oxyethyl]-6-methylheptan-2-yl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate
又称：[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate|.beta. -D-Xylopyranoside, (3.beta. ,4.beta. ,5.alpha.,6.alpha.,15.beta. ,16.beta. ,24R)-3,4,15,16-tetrahydroxy-6-(sulfooxy)stigmastan-29-yl 4-O-methyl-|[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(2R,5R)-5-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxyoxan-2-yl]oxyethyl]-6-methylheptan-2-yl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate|Stigmastane-3,4,6,15,16-pentol, 29-[(4-O-methyl-I(2)-D-xylopyranosyl)oxy]-, 6-(hydrogen sulfate), (3I(2),4I(2),5I+/-,6I+/-,15I(2),16I(2),24R)-
| 分子式 | C35H62O13S |
|---|---|
| 分子量 | 722.39 g/mol |
| LogP | 2.7 |
| 拓扑极性表面积 | 221.0 Ų |
| 氢键供体数 | 7 |
| 氢键受体数 | 13 |
| 可旋转键数 | 12 |
| 精确质量 | 722.3911 |
| 重原子数 | 49 |
| 复杂度 | 1210.0 |
化学标识符
| CAS 编号 | 753444-83-6 |
|---|---|
| SMILES | C[C@H](CC[C@H](CCO[C@H]1[C@@H]([C@H]([C@@H](CO1)OC)O)O)C(C)C)[C@H]2[C@H]([C@H]([C@@H]3[C@@]2(CC[C@H]4[C@H]3C[C@@H]([C@@H]5[C@@]4(CC[C@@H]([C@@H]5O)O)C)OS(=O)(=O)O)C)O)O |
| InChIKey | WTIPFRWIYJVRGS-XCIXNCJBSA-N |
产品概述
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate（CAS 753444-83-6），分子式为C35H62O13S，分子量为722.39 g/mol。IUPAC名：[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(2R,5R)-5-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxyoxan-2-yl]oxyethyl]-6-methylheptan-2-yl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate。
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate化学性质概览
属性洞察：[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的XLogP值为2.7，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221.0 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，[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate有7个氢键供体和13个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的CAS号是多少？
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的CAS号为753444-83-6。
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的分子式是什么？
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的分子式为C35H62O13S。
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的分子量是多少？
[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的分子量为722.39 g/mol。
在哪里可以购买[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate？
您可以直接向科弘生物询价[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate。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[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate的定制合成服务？
是的，科弘生物提供[(3S,4R,5R,6S,8R,9S,10R,13R,14S,15S,16R,17R)-17-[(1R,4R)-4-[2-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methoxy-tetrahydropyran-2-yl]oxyethyl]-1,5-dimethyl-hexyl]-3,4,15,16-tetrahydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate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。