(2R,3S,4R,5S)-4-amino-2-[6-(dimethylamino)-9H-purin-9-yl]-5-(hydroxymethyl)oxolan-3-ol

• ChemBase编号: 133753
• 分子式: C12H18N6O3
• 平均质量: 294.30972
• 单一同位素质量: 294.14403847
• SMILES: CN(C)c1c2c(ncn1)n(cn2)[C@H]1[C@H]([C@H]([C@H](O1)CO)N)O
• Canonical SMILES: OC[C@H]1O[C@H]([C@H]([C@H]1N)O)n1cnc2c1ncnc2N(C)C
• InChI: InChI=1S/C12H18N6O3/c1-17(2)10-8-11(15-4-14-10)18(5-16-8)12-9(20)7(13)6(3-19)21-12/h4-7,9,12,19-20H,3,13H2,1-2H3/t6-,7+,9+,12-/m1/s1
• InChIKey: RYSMHWILUNYBFW-VENHTOENSA-N

名称和登记号

名称

• IUPAC标准名: (2R,3S,4R,5S)-4-amino-2-[6-(dimethylamino)-9H-purin-9-yl]-5-(hydroxymethyl)oxolan-3-ol
• IUPAC传统名: (2R,3S,4R,5S)-4-amino-2-[6-(dimethylamino)purin-9-yl]-5-(hydroxymethyl)oxolan-3-ol
• 别名: 3′-Amino-3′-deoxy-N6,N6-dimethyladenosine; Puromycin aminonucleoside

登记号

• CAS号: 58-60-6
• EC号: 200-388-3
• MDL号: MFCD00063462
• Beilstein号: 93902
• PubChem SID: 24898823; 162228030
• PubChem CID: 16219893

理论计算性质

• Acid pKa: 12.978685
• 质子受体: 8
• 质子供体: 3
• LogD (pH = 5.5): -4.212318
• LogD (pH = 7.4): -2.7506952
• Log P: -1.2608758
• 摩尔折射率: 74.5813 cm^3
• 极化性: 29.03953 Å^3
• 极化表面积: 122.55 Å^2
• 可自由旋转的化学键: 3
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: H2O: soluble50 mg/mL, clear, slightly yellow

安全信息

• 欧盟危险性物质标志: 有害性(Harmful) (Xn)
• 德国WGK号: 3
• 危险公开号: 48/22
• GHS危险品标识: GHS08
• GHS警示词: Warning
• GHS危险声明: H373
• 个人保护装置: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• 保存温度: 2-8°C

药理学性质

• 作用器官: Kidney

产品相关信息

• 纯度: ≥99.0% (HPLC)
• 产品质量级别: PREMIUM
• Empirical Formula (Hill Notation): C12H18N6O3

详细说明

Sigma Aldrich - P7130

Biochem/physiol Actions
Puromycin aminonucleoside is used to study human glomerular disease by inducing damage of murine glomerular podocytes1 and is used to study glomerular function and morphology.
Protocols & Applications
Antibiotic Selector for application, solubility, solution stability, working concentration, and mode of action information