(2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfanyl)oxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide hydrochloride

• ChemBase编号: 133356
• 分子式: C18H34Cl2N2O5S
• 平均质量: 461.44396
• 单一同位素质量: 460.15654856
• SMILES: CCC[C@@H]1C[C@H](N(C1)C)C(=O)N[C@@H]([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)SC)O)O)O)[C@H](C)Cl.Cl
• Canonical SMILES: CCC[C@H]1CN([C@@H](C1)C(=O)N[C@@H]([C@H]1O[C@H](SC)[C@@H]([C@H]([C@H]1O)O)O)[C@@H](Cl)C)C.Cl
• InChI: InChI=1S/C18H33ClN2O5S.ClH/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4;/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25);1H/t9-,10+,11-,12+,13-,14+,15+,16+,18+;/m0./s1
• InChIKey: AUODDLQVRAJAJM-XJQDNNTCSA-N

名称和登记号

名称

• IUPAC标准名: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfanyl)oxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide hydrochloride
• IUPAC传统名: cleocin T gel hydrochloride
• 别名: (7S)-7-Chloro-7-deoxylincomycin hydrochloride; Cleocin; Clindamycin hydrochloride

登记号

• CAS号: 21462-39-5
• EC号: 244-398-6
• MDL号: MFCD07793327
• Beilstein号: 4070786
• PubChem SID: 24892772; 162227633
• PubChem CID: 16051951

理论计算性质

• Acid pKa: 12.163722
• 质子受体: 6
• 质子供体: 4
• LogD (pH = 5.5): -1.0028338
• LogD (pH = 7.4): 0.65432453
• Log P: 1.0377376
• 摩尔折射率: 105.7173 cm^3
• 极化性: 42.705715 Å^3
• 极化表面积: 102.26 Å^2
• 可自由旋转的化学键: 7
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: H2O: soluble50 mg/mL, clear, colorless

安全信息

• RTECS编号: GF2275000
• 德国WGK号: 2
• 个人保护装置: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• 保存温度: 2-8°C

产品相关信息

• 纯度: ≥96.0% (TLC)
• 杂质: ≤2 mol/mol EtOH
• Empirical Formula (Hill Notation): C18H33ClN2O5S · HCl

详细说明

Sigma Aldrich - C5269

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Analysis Note
Actual content on label
Other Notes
Antibacterial and antiprotozoal antibiotic of the licosamide class.
Application
Clindamycin is used to study bacterial infections, such as group B streptococcal disease, bacterial resistance and plasma protein binding 1,2,3.
Biochem/physiol Actions
Spectrum of Activity: Gram positive cocci and taxoplasma. Especially active against anaerobic bacteria.Mode of Action: Inhibits protein synthesis in bacteria by binding the 50s ribosomal subunit.Clindamycin is a semi-synthetic, lincosamide antibiotic that is prepared from lincomycin. It inhibits bacterial protein synthesis by hydrogen bond interactions with the 23S rRNA component of the 50S ribosomal subunit thus inducing dissociation of the peptidyl-t-RNA complex. Antibacterial and antiprotozoal antibiotic.
Protocols & Applications
Antibiotic Selector for application, solubility, solution stability, working concentration, and mode of action information

Sigma Aldrich - 27543

Other Notes
Antibacterial and antiprotozoal antibiotic of the licosamide class.
Review1
Biochem/physiol Actions
Spectrum of Activity: Gram positive cocci and taxoplasma. Especially active against anaerobic bacteria.Mode of Action: Inhibits protein synthesis in bacteria by binding the 50s ribosomal subunit.Clindamycin is a semi-synthetic, lincosamide antibiotic that is prepared from lincomycin. It inhibits bacterial protein synthesis by hydrogen bond interactions with the 23S rRNA component of the 50S ribosomal subunit thus inducing dissociation of the peptidyl-t-RNA complex. Antibacterial and antiprotozoal antibiotic.