Ethisterone 炔孕酮

CAS 434-03-7 MFCD00003656

化学结构图

434-03-7
SMILES: C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C

化学属性

Mol. FormulaC21H28O2
Mol. Weight312
Melting Point263-269
SolubilitySoluble in chloroform, DMSO (0.05 mg/ml), acetone (slightly ), ethanol (<1 mg/ml at 25 °C), and water (<1 mg/ml at 25 °C).

别名和识别编码

Chemical NameEthisterone
CAS Number434-03-7
Synonym 17 alpha Ethynyltestosterone 17 alpha-Ethynyltestosterone 17α-乙炔睾酮 17β-羟基-4,17α-孕甾烯-20-炔基-3-酮 4,17α-孕甾烯-17β-醇-20-炔基-3-酮 17?-Hydroxypregn-4-en-20-yn-3-one 17α-Ethynyltestosterone 4,17α-孕甾烯-17β-醇-20-炔基-3-酮 Aethisteron Anhydrohydroxyprogesterone Anhydroxyprogesterone Colutoid Ethinone Ethinyltestosterone Ethisterone Ethynyltestosterone Lutocylol Nalutoral Nugestoral Ora-Lutin Pranone Pregn-4-en-20-yn-3-one, 17-hydroxy-, (17-alpha)- Pregneninolone Pregnin Prodoxan Prodroxan Produxan Progestoral Proluton C Syngestrotabs Trosinone 炔孕酮 炔孕酮;17-乙炔睾(甾)酮;17α-乙炔睾酮;17β-羟基-4,17α-孕甾烯-20-炔基-3-酮;4,17α-孕甾烯-17β-醇-20-炔基-3-酮
MDL NumberMFCD00003656
PubChem Substance ID5284557
Beilstein Registry Number1889895
EC Number207-096-5
Reaxys-RN1889895
Merck Number3741
Chemical Name Translation炔孕酮
Wiswesser Line NotationL E5 B666 OV MUTJ A1 E1 FQ F1UU1
LabNetwork Molecule IDLN00854147
InChIInChI=1S/C21H28O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,13,16-18,23H,5-12H2,2-3H3/t16-,17+,18+,19+,20+,21+/m1/s1
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分类

  • {SNA} Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Application Areas and Market Segments, Chromatography, Clinical Standards, E, EQ - EZ, Hormones, Neats and Solutions, Pharma
  • Approved Therapeutics/Drug Candidates, Bioactive Small Molecules,
  • {S
  • {SNA} Alphabetic, Analytical Standards, Analytical/Chromatography, Chromatography, Clinical Standards, E, EQ - EZ, Hormones, Market Segments, Neats and Solutions, Standards for Food and Beverage Analysis, Standards for Pharma Clinical Forensic & Veterinary Analysis
  • {SNA} Approved Therapeutics/Drug Candidates,

产品应用

  • A progestogen compound.

相关文献及参考

  • Chung, B., et al.: J. Anal. Toxicol., 14, 91
  • Ogino, Y., et al., Evolutionary History And Functional Characterization Of Androgen Receptor Genes In Jawed Vertebrates. Endocrinology 150 , 5415-27, (2009) 摘要
  • Merck 14 ,3741
  • Beil. 8 ,III,1206
  • FT-IR 2 (3), 4239:A / FT-NMR 1 (3), 592:A / RegBook 1 (2), 2867:F / Sigma FT-IR 1 (1), 1252:B / Structure Index 1 , 459:B:4

安全信息

RTECSTU5570250
GHS Symbol
Precautionary statements
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前，切勿操作。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P281 Use personal protective equipment as required. 使用所需的个人防护装备。
  • P308+P313
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H351 Suspected of causing cancer 怀疑致癌
  • H360 May damage fertility or the unborn child 可能对生育能力或未出生婴儿造成伤害
Hazard Codes T Xn
WGK Germany3
Personal Protective Equipment Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
Signal word Danger
Safety Statements
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
  • S53 Avoid exposure - obtain special instructions before use 避免接触，使用前获得特别指示说明；
Risk Statements
  • R61 May cause harm to the unborn child 可能对未出生的婴儿导致伤害
UN Number 2811
Storage condition 储存温度-20°C 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - woman
DOSE                    : 79800 ug/kg
SEX/DURATION            : female 8-26 week(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
   JCEMAZ Journal of Clinical Endocrinology and Metabolism.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.12-    1952-
   Volume(issue)/page/year: 18,559,1958

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - woman
DOSE                    : 81900 ug/kg
SEX/DURATION            : female 16-28 week(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
   JCEMAZ Journal of

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - woman
DOSE                    : 21 mg/kg
SEX/DURATION            : female 11-15 week(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
   JCEMAZ Journal of Clinical Endocrinology and Metabolism.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.12-    1952-
   Volume(issue)/page/year:

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - woman
DOSE                    : 386 mg/kg
SEX/DURATION            : female 6-28 week(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
   AJOGAH American Journal of Obstetrics and Gynecology.  (C.V. Mosby Co.,
   11830 Westline Industrial Dr., St. Louis, MO 63146)  V.1-    1920-
   Volume(issue)/page/year: 84,962,1962

其他信息

  • 炔孕酮
  • Ethisterone是一种孕激素，可以治疗前列腺癌。

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Market Segments - Analytical Standards
  4. Standards for Pharma Clinical Forensic &amp; Veterinary Analysis - Market Segments
  5. Neats and Solutions - Standards for Pharma Clinical Forensic &amp; Veterinary Analysis
  6. Hormones - Neats and Solutions
  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Cell Signaling and Neuroscience - Cell Biology
  4. Cytokines, Growth Factors and Hormones - Cell Signaling and Neuroscience
  5. Hormones - Cytokines, Growth Factors and Hormones
  6. Steroid Hormones - Hormones
  7. Other Steroid Products - Steroid Hormones
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Acetylenes 炔烃
  1. Life Science 生命科学
  2. Biochemistry / Glyco-Chemistry
  3. Steroids

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