卤米松结构式
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常用名 | 卤米松 | 英文名 | Halometasone |
|---|---|---|---|---|
| CAS号 | 50629-82-8 | 分子量 | 444.897 | |
| 密度 | 1.4±0.1 g/cm3 | 沸点 | 600.5±55.0 °C at 760 mmHg | |
| 分子式 | C22H27ClF2O5 | 熔点 | 125-130 °C(lit.) | |
| MSDS | N/A | 闪点 | 317.0±31.5 °C |
卤米松用途【用途一】 局部用肾上腺皮质激素类药物,有显著且快速的抗炎、抗过敏、抗瘙痒、抗渗出及抗增生的作用。适用于湿疹性皮肤病及各类轻度湿疹性和亚急性皮炎。 |
| 中文名 | 卤米松 |
|---|---|
| 英文名 | Halometasone |
| 中文别名 | (6Α,11Β,16Α)-2-氯-6,9-二氟-11,17,21-三羟基-16-甲基孕甾-1,4-二烯-3,20-二酮 | 卤甲松 |
| 英文别名 | 更多 |
| 密度 | 1.4±0.1 g/cm3 |
|---|---|
| 沸点 | 600.5±55.0 °C at 760 mmHg |
| 熔点 | 125-130 °C(lit.) |
| 分子式 | C22H27ClF2O5 |
| 分子量 | 444.897 |
| 闪点 | 317.0±31.5 °C |
| 精确质量 | 444.151520 |
| PSA | 94.83000 |
| LogP | 2.33 |
| InChIKey | GGXMRPUKBWXVHE-MIHLVHIWSA-N |
| SMILES | CC1CC2C3CC(F)C4=CC(=O)C(Cl)=CC4(C)C3(F)C(O)CC2(C)C1(O)C(=O)CO |
| 蒸汽压 | 0.0±3.9 mmHg at 25°C |
| 折射率 | 1.586 |
| 储存条件 | 室温 |
| 分子结构 | 1、 摩尔折射率:104.93 2、 摩尔体积(cm3/mol):312.8 3、 等张比容(90.2K):854.6 4、 表面张力(dyne/cm):55.6 5、 极化率(10-24cm3):41.60 |
| 危害码 (欧洲) | Xn |
|---|---|
| 安全声明 (欧洲) | S22-S24/25 |
| WGK德国 | 3 |
化合物(Ⅰ)先和氯气反应,对1、2位双键进行加成,再在吡啶作用下,脱去氯化氢,在1、2位重新形成双键;然后水解,得到卤米松。
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实验名称:Binding affinity towards rat Gabra1 in an in vitro assay with cellular components mea...
来源:ChEMBL
靶标:Gamma-aminobutyric acid receptor subunit alpha-1
External Id:CHEMBL5291800
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实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
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实验名称:qHTS Assay for Inhibitors of the Phosphatase Activity of Eya2
来源:NCGC
靶标:eyes absent homolog 2 isoform a [Homo sapiens]
External Id:EYA2477
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实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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实验名称:Binding affinity towards human ESR1 in an in vitro cell free assay (CRO assay) measur...
来源:ChEMBL
靶标:Estrogen receptor
External Id:CHEMBL5291792
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实验名称:Antibacterial activity against Staphylococcus aureus MRSA ATCC 43300 (CO-ADD:GP_020);...
来源:ChEMBL
靶标:Staphylococcus aureus
External Id:CHEMBL4296184
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实验名称:Compound was evaluated for inhibition of human F2 in an in vitro cell free assay meas...
来源:ChEMBL
靶标:Prothrombin
External Id:CHEMBL5291794
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实验名称:Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
来源:ChEMBL
靶标:Klebsiella pneumoniae
External Id:CHEMBL4296186
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实验名称:Primary cell-based high-throughput screening for identification of compounds that all...
来源:Johns Hopkins Ion Channel Center
靶标:MAS-related GPR member X1 [Homo sapiens]
External Id:JHICC_MrgX1_AlloAgonist_Primary
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实验名称:Antibacterial activity against Escherichia coli ATCC 25922 (CO-ADD:GN_001); MIC in CA...
来源:ChEMBL
靶标:Escherichia coli
External Id:CHEMBL4296185
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| 2-Chloro-6a,9-difluoro-11b,17,21-trihydroxy-16a-methylpregna-1,4-diene-3,20-dione |
| 2-Chloro-6α,9-difluoro-11β,17,21-trihydroxy-16α-methylpregna-1,4-diene-3,20-dione |
| MFCD00866091 |
| (6a,11b,16a)-2-Chloro-6,9-difluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione |
| 2-Chlor-6α,9-difluor-11β,17,21-trihydroxy-16α-methyl-1,4-pregnadien-3,20-dion |
| Halometasone |
| (6α,11β,16α)-2-Chloro-6,9-difluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione |
| C 48401-Ba |
| EINECS 256-664-9 |
| (6S,8S,9R,10S,11S,13S,14S,16R,17R)-2-chloro-6,9-difluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one |
| 2-CHLOROFLUMETHASONE |
| Sicorten |