醋酸去氧皮质酮, 矿质皮质激素受体激动剂

肌内注射类固醇激素用于肾上腺皮质类固醇替代疗法
  • 10mM in DMSO
有货

库存信息

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货号 (SKU) 包装规格 是否现货 价格 数量
D424780-1ml
1ml 现货 Stock Image
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Compound libraries (12326)

基本描述

别名 DOC acetate | 乙酸去氧皮质酮 | Doca
英文别名 Deoxycorticosterone acetate | 56-47-3 | DESOXYCORTICOSTERONE ACETATE | DOCA | Desoxycortone acetate | Cortexone acetate | Percotol | DOC acetate | Decosteron | Decosterone | Sincortex | 11-Deoxycorticosterone acetate | Decostrate | Descorterone | Docaquosum | Dorcostrin | Krinocorts | Pri
规格或纯度 10mM in DMSO
英文名称 Deoxycorticosterone acetate
生化机理 类固醇激素通常用于诱发实验动物的高血压。这种形式的高血压取决于对包括大脑肾素-血管紧张素系统在内的中枢升压机制的调节。
储存温度 -80℃储存
运输条件 超低温冰袋运输
作用类型 激动剂
作用机制 矿质皮质激素受体激动剂
产品介绍

Deoxycorticosterone acetate是一种类固醇激素,用于肌肉注射,是肾上腺皮质类固醇的代替疗法。

Deoxycorticosterone acetate is a steroid hormone used for intramuscular injection for replacement therapy of the adrenocortical steroid.

AI解读

产品属性

ALogP 3.1

关联靶点(人)

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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
GLP1R Tclin Glucagon-like peptide 1 receptor (111429 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SMN1 Tchem Survival motor neuron protein (34246 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
LMNA Tbio Prelamin-A/C (36751 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
GMNN Tbio Geminin (128009 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MEN1 Tchem Menin/Histone-lysine N-methyltransferase MLL (48157 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

关联靶点(其它种属)

Plasmodium falciparum (966862 活性数据)
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rep Replicase polyprotein 1ab (378 活性数据)
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TGR Thioredoxin glutathione reductase (28579 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Mapt Microtubule-associated protein tau (6 活性数据)
活性类型 Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SARS-CoV-2 (38078 活性数据)
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作用机制

作用机制 Action Type target ID Target Name Target Type Target Organism Binding Site Name 参考文献

名称和识别符

EC号 200-275-9
分子类型 小分子
IUPAC Name [2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
INCHI InChI=1S/C23H32O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h12,17-20H,4-11,13H2,1-3H3/t17-,18-,19-,20+,22-,23-/m0/s1
InChi Key VPGRYOFKCNULNK-ACXQXYJUSA-N
Canonical SMILES CC(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
Isomeric SMILES CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C
WGK Germany 3
RTECS HG0525000
PubChem CID 5952
分子量 372.5
Beilstein号 2570798

化学和物理性质

比旋光度 20/D: +170.0 to +180.0 deg(C=1, Dioxane)
熔点 157°C
分子量 372.500 g/mol
XLogP3 3.100
氢键供体数Hydrogen Bond Donor Count 0
氢键受体数Hydrogen Bond Acceptor Count 4
可旋转键计数Rotatable Bond Count 4
精确质量Exact Mass 372.23 Da
单同位素质量Monoisotopic Mass 372.23 Da
拓扑极表面积Topological Polar Surface Area 60.400 Ų
重原子数Heavy Atom Count 27
形式电荷Formal Charge 0
复杂度Complexity 707.000
同位素原子数Isotope Atom Count 0
定义的原子立体中心计数Defined Atom Stereocenter Count 6
未定义的原子立体中心计数Undefined Atom Stereocenter Count 0
定义的键立体中心计数Defined Bond Stereocenter Count 0
未定义的键立体中心计数Undefined Bond Stereocenter Count 0
所有立体化学键的总数The total count of all stereochemical bonds 0
共价键合单元计数Covalently-Bonded Unit Count 1

安全和危险性(GHS)

象形图 GHS08
信号词 Danger
危险声明

H373: 通过长时间或反复暴露对器官造成损害

H360: 可能损害生育力或未出生的孩子

预防措施声明

P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。

P405: 密闭存放

P501: 将内容物/容器处理到。。。

P260: 不要吸入灰尘/烟雾/气体/雾/蒸汽/喷雾。

P203: 使用前,获取、阅读并遵守所有安全说明。

P318: 如果暴露或担心,请就医。

P319: 如果你感到不适,请寻求医疗帮助。

WGK Germany 3
RTECS HG0525000
个人防护装备 Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

技术规格说明书

concentration (1mL in DMSO) 9.0-11.0(mmol/L)
NMR Spectrum 1H Conforms to Structure

质检证书(CoA,COO,BSE/TSE 和分析图谱)

C of A & Other Certificates(BSE/TSE, COO):
输入批号以搜索分析图谱:

此产品的引用文献

1. Hao Jiameng, Chang Liping, Wang Dandong, Ji Chuanyuan, Zhang Shaolan, Hou Yunlong, Wu Yiling.  (2023)  Periplocin Alleviates Cardiac Remodeling in DOCA-Salt–Induced Heart Failure Rats.  Journal of Cardiovascular Translational Research,  16  (1): (127-140).  [PMID:35616880] [10.1007/s12265-022-10277-2]
2. Yanhong Liu, Lingchao Li, Jiyong Liu, Mengnan Yang, Honglan Wang, Xuxin Chu, Jianping Zhou, Meirong Huo, Tingjie Yin.  (2021)  Biomineralization-inspired dasatinib nanodrug with sequential infiltration for effective solid tumor treatment.  BIOMATERIALS,  267  (120481).  [PMID:33189053] [10.1016/j.biomaterials.2020.120481]

参考文献

1. Hao Jiameng, Chang Liping, Wang Dandong, Ji Chuanyuan, Zhang Shaolan, Hou Yunlong, Wu Yiling.  (2023)  Periplocin Alleviates Cardiac Remodeling in DOCA-Salt–Induced Heart Failure Rats.  Journal of Cardiovascular Translational Research,  16  (1): (127-140).  [PMID:35616880] [10.1007/s12265-022-10277-2]
2. Yanhong Liu, Lingchao Li, Jiyong Liu, Mengnan Yang, Honglan Wang, Xuxin Chu, Jianping Zhou, Meirong Huo, Tingjie Yin.  (2021)  Biomineralization-inspired dasatinib nanodrug with sequential infiltration for effective solid tumor treatment.  BIOMATERIALS,  267  (120481).  [PMID:33189053] [10.1016/j.biomaterials.2020.120481]

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