Deoxycorticosterone acetate - 10mM in DMSO , Mineralocorticoid receptor agonist, CAS No.56-47-3, Mineralocorticoid receptor agonist

CAS: 56-47-3 Cat. No.: D424780 Summenformel: C₂₃H₃₂O₄ Molekulargewicht: 372.5 Beilstein Registry Number: 2570798 EG-Nummer: 200-275-9

GRADE & PURITY 10mM in DMSO

Synonyms

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

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Übersicht

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

Specifications

Synonyme

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

Spezifikationen & Reinheit

10mM in DMSO

Biochemische und physiologische Mechanismen

Steroid hormone commonly used to induce hypertension in experimental animals. This form of hypertension is dependent on altered regulation of central pressor mechanisms including the brain renin-angiotensin system.

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

AGONIST

Mechanismus der Wirkung

Mineralocorticoid receptor agonist

Produkteigenschaften

• ALogP: 3.1

Namen und Kennungen

• Pubchem Sid: 528775993
• Kanonisches Lächeln: CC(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
• 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
• InChIKey: VPGRYOFKCNULNK-ACXQXYJUSA-N
• 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
• Isomere 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 Deutschland: 3
• RTECS: HG0525000
• Molekulargewicht: 372.5
• Beilstein: 2570798
• Reaxy-Rn: 1894700
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1894700&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Klasse Steroids and steroid derivatives
      • Subclass Pregnane steroids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Steroids and steroid derivatives
• Subclass: Pregnane steroids
• Intermediate Tree Nodes: Not available
• Direct Parent: Gluco/mineralocorticoids, progestogins and derivatives
• Alternative Parents: 20-oxosteroids 3-oxo delta-4-steroids Delta-4-steroids Cyclohexenones Alpha-acyloxy ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Progestogin-skeleton - 20-oxosteroid - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - Delta-4-steroid - Cyclohexenone - Alpha-acyloxy ketone - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic oxide - Aliphatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety.
• External Descriptors: corticosteroid hormone

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Zugehörige Ziele (menschlich)

PGR Tclin Progesterone receptor (8562 Activities)

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VDR Tclin Vitamin D receptor (26531 Activities)

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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

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GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

Discover Target: GLP1R

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APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

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SMN1 Tchem Survival motor neuron protein (34246 Activities)

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LMNA Tbio Prelamin-A/C (36751 Activities)

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GMNN Tbio Geminin (128009 Activities)

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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)

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SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)

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MEN1 Tchem Menin/Histone-lysine N-methyltransferase MLL (48157 Activities)

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Zugehörige Ziele (nicht menschlich)

Plasmodium falciparum (966862 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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TGR Thioredoxin glutathione reductase (28579 Activities)

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Mapt Microtubule-associated protein tau (6 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Spezifische Drehung [α]: 20/D： +170.0 to +180.0 deg(C=1, Dioxane)
• Schmelzpunkt (°C): 157°C
• Molekulargewicht: 372.500 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 372.23 Da
• Monoisotopic Mass: 372.23 Da
• Topological Polar Surface Area: 60.400 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 707.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 6
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referenzen

1. Hao Jiameng, Chang Liping, Wang Dandong, Ji Chuanyuan, Zhang Shaolan, Hou Yunlong, Wu Yiling.  (2022)  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.  (2020)  Biomineralization-inspired dasatinib nanodrug with sequential infiltration for effective solid tumor treatment.  BIOMATERIALS,      [PMID:33189053] [10.1016/j.biomaterials.2020.120481]

3. Yuanyuan Xu, Younan Ren, Jie Zhang, Bo Niu, Mengru Liu, Tifei Xu, Xian Zhang, Jianhua Shen, Kai Wang, Zhengyu Cao.  (2024)  Discovery of pyridazinone derivatives bearing tetrahydroimidazo[1,2-a]pyrazine scaffold as potent inhibitors of transient receptor potential canonical 5 to ameliorate hypertension-induced renal injury in rats.  EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY,      [PMID:38878518] [10.1016/j.ejmech.2024.116565]

4. Tingting Zhou, Zhiwei Wang, Xiaowang Lv, Mengting Guo, Ning Zhang, Liangju Liu, Li Geng, Jing Shao, Ka Zhang, Mengru Gao, Aiqin Mao, Yifei Zhu, Fan Yu, Lei Feng, Xiaoyan Wang, Qixiao Zhai, Wei Chen, Xin Ma.  (2025)  Targeting gut S. aureofaciens Tü117 serves as a new potential therapeutic intervention for the prevention and treatment of hypertension.  Cell Metabolism,      [PMID:39908987] [10.1016/j.cmet.2025.01.004]

5. Long Xu, Xinyan Wu, Luosha Long, Suchun Li, Meiying Huang, Meng Li, Pinning Feng, Moshe Levi, Wei Chen, Lei Wang, Chunling Li, Weidong Wang.  (2025)  TGR5 attenuates DOCA-salt hypertension through regulating histone H3K4 methylation of ENaC in the kidney.  METABOLISM-CLINICAL AND EXPERIMENTAL,      [PMID:39824478] [10.1016/j.metabol.2025.156133]