PREGNA-1,4-DIENE-3,20-DIONE, 11,17-DIHYDROXY-6-METHYL-21-(PHOSPHONOOXY)-, DISODIUM SALT, (6ALPHA,11B

Methylprednisolone Sodium Phosphate

HCID 21115CAS 5015-36-1

子结构检索查找相似结构

基本信息

标准SMILES: C[C@H]1C[C@@H]2[C@H]([C@@H](O)C[C@@]3(C)[C@H]2CC[C@]3(O)C(=O)COP(=O)([O-])[O-])[C@@]2(C)C=CC(=O)C=C12.[Na+].[Na+]
InChIKey: FVKLXKOXTMCACB-VJWYNRERSA-L
分子式: C22H29Na2O8P
平均分子量: 498.4 g/mol
单同位素质量: 498.13954308

概述

RN given refers to di-Na salt(6alpha,11beta)-isomer

名称与标识

首选名称: Methylprednisolone Sodium Phosphate
IUPAC: disodium;[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate
中文名: PREGNA-1,4-DIENE-3,20-DIONE, 11,17-DIHYDROXY-6-METHYL-21-(PHOSPHONOOXY)-, DISODIUM SALT, (6ALPHA,11B
英文名: Pregna-1,4-diene-3,20-dione, 11,17-dihydroxy-6-methyl-21-(phosphonooxy)-, disodium salt, (6alpha,11beta)-
分子式: C66H90Na3O19P
分子量: 1287.352471

名称与别名

METHYLPREDNISOLONE SODIUM PHOSPHATE5015-36-1Medrol StabisolU-12,019E6089CVN95VU-12019EDTXSID30198222RefChem:158296DTXCID60120713225-694-4Methylprednisolone Sodium Phosphate [USAN]11beta,17,21-Trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione 21-(disodium phosphate)

展开更多名称

甲泼尼龙磷酸二钠甲泼尼龙磷酸二钠(甲泼尼龙杂质17)Methylprednisolone Disodium Phosphate11β,17,20-Trihydroxy-6α-methylpregna-1,4-diene-3,20-dione 21-disodium phosphate11β,17-Dihydroxy-6-methyl-21-phosphonooxypregna-1,4-diene-3,20-dione disodium saltdisodium [2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphatedisodium [2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] phosphatedisodium [2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-3-keto-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-keto-ethyl] phosphate

disodium;[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphateMethylprednisolone sodium phosphate (USAN)UNII-6089CVN95VEINECS 225-694-4U 12,019ESCHEMBL1237362CHEMBL3989785Pregna-1,4-diene-3,20-dione, 11,17-dihydroxy-6-methyl-21-(phosphonooxy)-, disodium salt, (6alpha,11beta)-

数据库标识

CAS: 5015-36-1
PubChem CID: 21115
DTXSID: DTXSID30198222
ChEMBL: CHEMBL3989785
UNII: 6089CVN95V
EC Number: 225-694-4
Nikkaji: J658.569H

性质

结构计算性质

极性表面积: 147 Å²
氢键供体: 2
氢键受体: 8
可旋转键: 3
重原子: 33
形式电荷: 0
复杂度: 909

化学与工业

供应商1 家

陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]

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