Pentamidine isethionate 喷他脒羟乙磺酸盐

CAS 140-64-7 MFCD00079213

化学结构图

140-64-7
SMILES: N=C(N)c1ccc(OCCCCCOc2ccc(C(=N)N)cc2)cc1.O=S(=O)(O)CCO.O=S(=O)(O)CCO

化学属性

Mol. FormulaCH2[CH2CH2OC6H4C(=NH)NH2]2·2HOCH2CH2SO3H
Mol. Weight593
Melting Point188-194 °C(lit.)
Appearance powder

别名和识别编码

Chemical NamePentamidine isethionate
Synonym 1,5-BIS(P-AMIDINOPHENOXY)PENTANE BIS(2-HYD 1,5-BIS[P-AMIDINOPHENOXY]PENTANE BIS[2-HYDROXYETHANESULFONATE SALT] ISETHIONATE SALT 1,5-Bis(p-amidinophenoxy)pentane bis(2-hydroxyethanesulfonate salt) 4,4'-(Pentamethylenedioxy)dibenzamidine bis(2-hydroxyethanesulfonate) 2512 R.P. 4,4'-(PENTAMETHYLENEDIOXY)DIBEN 4,4'-(PENTAMETHYLENEDIOXY)DIBENZAMIDE BIS(2-HYDROXYETHANESULFONATE) 4,4'-(Pentamethylenedioxy)-dibenzamidine bis(2-hydroxyethanesulfonate) 4,4'-(Pentamethylenedioxy)dibenzamidine bis(2-hydroxyethanesulfonate) 4,4'-(pentamethylenedioxy)dibenzamidine bis(2-hyd 4,4'-(五亚甲基二氧代)二苯甲脒二羟乙基磺酸盐 4,4'-Diamidino-alpha,omega-diphenoxypentane isethionate 4,4'-Diamidinodiphenoxypentane di(beta-hydroxyethanesulfonate) 4,4μ-(Pentamethylenedioxy)dibenzamidine bis(2-hydroxyethanesulfonate), 1,5-Bis(p-amidinophenoxy)pentane bis(2-hydroxyethanesulfonate salt) Benambax Benzamidine, 4,4'-(pentamethylenedioxy)di-, bis(beta-hydroxyethanesulfonate) Lomidin Lomidine Lomidine isoethionate M & B 80 PENTAMIDINE DIISETHIONATE PENTAMIDINE ISETHIONATE PENTAMIDINE ISETHIONATE NMDA ANTAG PENTAMIDINE ISETHIONATE SALT PENTAMINE ISETHIONATE PENTAMINIDE ISETIONATE Pentamide Isethionate Pentamidine diisethionate Pentamidine isethionate Pentamidine isethionate salt R.P. 2512 USAF XR-10 WR 4931 p,p'-(Pentamethylenedioxy)dibenzamidine bis(beta-hydroxye p,p'-[Pentamethylenedioxy] dibenzamidine bis[β-hydroxyethanesulfonate] pentamidine isetionate {} {} {} {C 喷他脒羟乙磺酸盐 喷它
MDL NumberMFCD00079213
PubChem Substance ID8813
EC Number205-424-1
CAS Number140-64-7
Chemical Name Translation喷他脒羟乙磺酸盐
Merck Number13,7192
Wiswesser Line NotationMUYZR DO5OR DYZUM &WSQ2Q 2
LabNetwork Molecule IDLN00188471
InChIInChI=1S/C19H24N4O2.2C2H6O4S/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23;2*3-1-2-7(4,5)6/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23);2*3H,1-2H2,(H,4,5,6)
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分类

  • {SNA} Antibacterial, Antibiotics A to Z, Antibiotics N-S, Approved Therapeutics/Drug Candidates, Bioactive Small Molecule Alphabetical Index, Celgene, Excitatory Amino Acids, Inhibits an Enzyme, Ion Channels, Ionotropic Glutamate Receptor Modulators, L - Z, Ligand-Gated Ion Channels, Mechanism of Action, NMDA Antagonists, Neuroscience, Neurotransmission, Neurotransmitters, P-PH, Spectrum of Activity, 抗生素, 生化试剂, 生物活性小分子, 细胞信号转导和神经科学, 细胞生物学
  • {SNA} Antibacterial, Antibiotics,

相关文献及参考

  • [2]. Nguewa, P.A., et al., Pentamidine is an antiparasitic and apoptotic drug that selectively modifies ubiquitin. Chem Biodivers, 2005. 2(10): p. 1387-400.
  • [3]. Sands M, et al. Pentamidine: a review. Rev Infect Dis. 1985 Sep-Oct;7(5):625-34.
  • [4]. David C. Bean, et al. Pentamidine: a drug to consider re-purposing in the targeted treatment of multi-drug resistant bacterial infections? J Lab Precis Med 2017;2:49.
  • [1]. Pathak MK, et al. Pentamidine is an inhibitor of PRL phosphatases with anticancer activity. Mol Cancer Ther. 2002 Dec;1(14):1255-64.
  • [1]. Pathak MK, et al. Pentamidine is an inhibitor of PRL phosphatases with anticancer activity. Mol Cancer Ther. 2002 Dec;1(14):1255-64.
  • [2]. Nguewa, P.A., et al., Pentamidine is an antiparasitic and apoptotic drug that selectively modifies ubiquitin. Chem Biodivers, 2005. 2(10): p. 1387-400.
  • [3]. Sands M, et al. Pentamidine: a review. Rev Infect Dis. 1985 Sep-Oct;7(5):625-34.
  • {MCE

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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。
  • P305+P351+P338
Signal word Warning
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
RTECSCV6500000
Hazard Codes Xi
Safety Statements
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
Packing GroupIII
Hazard Class6.1(b)
Storage condition -20°C
UN Number 3249 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 15100 ug/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - other changes
REFERENCE :
   ANTCAO Antibiotics and Chemotherapy (Washington, DC).  (Washington, DC)
   V.1-12, 1951-62.  For publisher information, see CLMEA3.
   Volume(issue)/page/year: 2,581,1952

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Human - woman
DOSE/DURATION           : 6 mg/kg/D
TOXIC EFFECTS :
   Blood - hemorrhage
   Skin and Appendages - dermatitis, other (after systemic exposure)
REFERENCE :
   CANCAR Cancer (Philadelphia).  (Lippincott/Harper, Journal Fulfillment
   Dept., 2350 Virginia Ave., Hagerstown, MD 21740)  V.1-    1948-
   Volume(issue)/page/year: 34,441,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 63 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - other changes
REFERENCE :
   ANTCAO Antibiotics and Chemotherapy (Washington, DC).  (Washington, DC)
   V.1-12, 1951-62.  For publisher information, see CLMEA3.
   Volume(issue)/page/year: 2,581,1952

TYPE OF TEST            : TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Human - man
DOSE/DURATION           : 21429 ug/kg/5D-I
TOXIC EFFECTS :
   Endocrine - hypoglycemia
   Skin and Appendages - sweating
REFERENCE :
   AIMEAS Annals of Internal Medicine.  (American College of Physicians, 4200
   Pine St., Philadelphia, PA 19104)  V.1-    1927-  Volume(issue)/page/year:
   108,490,1988

TYPE OF TEST            : DNA inhibition
TEST SYSTEM             : Rodent - mouse Leukocyte
DOSE/DURATION           : 29500 ug/L
REFERENCE :
   INNDDK Investigational New Drugs. The Journal of New Anticancer Agents.
   Kluwer Academic Pub., POB 358, Accord Stn., Hingham, MA 02018)  V.1- 1983- 
   Volume(issue)/page/year: 1,103,1983

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 24 mg/kg
SEX/DURATION            : female 6-11 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
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: 163,912,1990

其他信息

  • Sigma Aldrich:140-64-7(sigmaaldrich)
  • MOL 文件:140-64-7.mol
  • MSDS 信息:Pentamidine isethionate(140-64-7).msds

系列性分类

  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Bioactive Small Molecules - Cell Biology
  4. P - Bioactive Small Molecules
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Imines/Amidines - Nitrogen Compounds
  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Cell Signaling and Neuroscience - Cell Biology
  4. Ion Channels - Cell Signaling and Neuroscience
  5. Ligand-Gated Ion Channels - Ion Channels
  6. Ionotropic Glutamate Receptor Modulators - Ligand-Gated Ion Channels
  1. Functional Group 官能团索引
  2. carboxylic acid amidine
  1. Medical Research Areas
  2. Metabolism
  3. Phosphatase  (磷酸酶)

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