基本情報
- CAS
27480-30-4- 標準SMILES
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](OP(=O)(O)O)[C@@H](O)[C@H]2O)[C@@H](C)O)N(C)C1- InChIKey
NVNQOUOFMWKNLY-UHFFFAOYSA-N- 分子式
- C18H35N2O9PS
- 平均分子量
- 486.5 g/mol
- 単同位体質量
- 486.18008887
名称と識別子
- 優先名称
- Lincomycin-2-phosphate
- IUPAC
- [(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-[(1R,2R)-2-hydroxy-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-2-methylsulfanyloxan-3-yl] dihydrogen phosphate
- 英語名
- LincoMycin 2-Phosphate
- 分子式
- C18H35N2O9PS
- 分子量
- 486.52
名称と別名
Lincomycin 2-phosphate27480-30-4Lincomycin-2-phosphateG4RBJ6PFR6D-Erythro-alpha-D-galacto-octopyranoside, methyl 6,8-dideoxy-6-((((2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl)carbonyl)amino)-1-thio-, 2-(dihydrogen phosphate)D-Erythro-alpha-D-galacto-octopyranoside, methyl 6,8-dideoxy-6-(((1-methyl-4-propyl-2-pyrrolidinyl)carbonyl)amino)-1-thio-, 2-(dihydrogen phosphate), (2S-trans)-D-Erythro-D-galacto-octopyranoside, methyl 6,8-dideoxy-6-(1-methyl-4-propyl-L-2-pyrrolidinecarboxamido)-1-thio-, 2-(dihydrogen phosphate), trans-alpha-Methyl 6,8-dideoxy-6-((((2S,4R)-1-methyl-4-propylpyrrolidin-2-yl)carbonyl)amino)-2-o-PHOSPHONO-1-thio-D-erythro-alpha-D-galacto-octopyranosideRefChem:1088477(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-((1R,2R)-2-hydroxy-1-((2S,4R)-1-methyl-4-propylpyrrolidine-2-carboxamido)propyl)-2-(methylthio)tetrahydro-2H-pyran-3-yl dihydrogen phosphateClindamycin Phosphate EP Impurity F[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-[(1R,2R)-2-hydroxy-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-2-methylsulfanyloxan-3-yl] dihydrogen phosphate
物性
構造計算による物性
- XLogP
- -3.2
- 極性表面積
- 194 Ų
- 水素結合供与体数
- 6
- 水素結合受容体数
- 11
- 回転可能結合数
- 9
- 重原子数
- 31
- 形式電荷
- 0
- 複雑度
- 654
物理化学的性質
- 融点
- 208 °C · >208°C (dec.)
- 比重(密度)
- 1.42 · 1.42±0.1 g/cm3(Predicted)
- 貯蔵温度
- -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
- 溶解性
- メタノール（微量、加温）、水（微量）
- 酸解離定数(Pka)
- 1.83 · 1.83±0.10(Predicted)
- 外見
- 個体
- 色
- ホワイトからオフホワイト
- 安定性
- Hygroscopic
- InChIKey
- NVNQOUOFMWKNLY-UHFFFAOYSA-N
- SMILES
- C(C1C(C(O)C(OP(O)(O)=O)C(SC)O1)O)(C(O)C)NC(C1N(CC(CCC)C1)C)=O
化学的性質
化学的特性Lincomycin 2-Phosphate (Clindamycin Phosphate EP Impurity F) is the derivative of Lincomycin (L466200), a lincosamide antibiotic that forms cross-links within the peptidyl transferase loop region of the 23S rRNA. Inhibits bacterial protein synthesis.
化学と産業
応用分野
説明Lincomycin 2-Phosphate is the derivative of Lincomycin, a lincosamide antibiotic that forms cross-links within the peptidyl transferase loop region of 23S rRNA. Lincomycin 2-Phosphate is also known as Clindamycin Phosphate EP Impurity F, methyl 6,8-dideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-D-erythro-α-D-galacto-Octopyranoside 2-(dihydrogen phosphate), and methyl 6,8-dideoxy-6-[[[(2S,4R)-1-methyl-4-propylpyrrolidin-2-yl]carbonyl]amino]-2-O-phosphono-1-thio-D-erythro-α-D-galacto-octopyranoside.
使用Lincomycin 2-Phosphate (Clindamycin Phosphate EP Impurity F) is the derivative of Lincomycin (L466200), a lincosamide antibiotic that forms cross-links within the peptidyl transferase loop region of the 23S rRNA. Inhibits bacterial protein synthesis. Antibacterial.
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上海策嵘生物科技有限公司[email protected]
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广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
Guangzhou Tosun Pharmaceutical Limited+86-18124244216 +86-18124244216 · [email protected]
深圳市简一生物科技有限公司0755-84826604 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
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