(2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol 6-苄氨基-9-(Α-D-吡喃葡萄糖基)嘌呤
CAS 4294-17-1 MFCD00189345
化学结构图
SMILES: OC[C@H]1O[C@@H](n2cnc3/c(=N/Cc4ccccc4)[nH]cnc32)[C@H](O)[C@@H](O)[C@@H]1O
化学属性
| Mol. Formula | C18H21N5O6 |
|---|---|
| Mol. Weight | 403.39 |
| Melting Point | 179 °C |
别名和识别编码
| Chemical Name | (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol |
|---|---|
| MDL Number | MFCD00189345 |
| CAS Number | 4294-17-1 |
| Synonym | (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {LY} (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {} {LY} (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {} {} {LY} (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {} {} {} {LY} (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {} {} {} {} {LY} (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {} {} {} {} {} {LY} (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {} {} {} {} {} {} {LY} (2R,3R,4S,5S,6R)-2-((6-(Benzylamino)-9H-purin-9-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol {} {} {} {} {} {} {} {LY} (2R,3R,4S,5S,6R)-2-(( |
| PubChem Substance ID | 11552796 |
| Chemical Name Translation | 6-苄氨基-9-(Α-D-吡喃葡萄糖基)嘌呤 |
| LabNetwork Molecule ID | LN02125790 |
| Canonical SMILES | O[C@H]1[C@H](O)[C@@H](O)[C@@H](ON2C3=NC=NC(NCC4=CC=CC=C4)=C3N=C2)O[C@@H]1CO |
| InChI | InChI=1S/C18H21N5O5/c24-7-11-13(25)14(26)15(27)18(28-11)23-9-22-12-16(20-8-21-17(12)23)19-6-10-4-2-1-3-5-10/h1-5,8-9,11,13-15,18,24-27H,6-7H2,(H,19,20,21)/t11-,13-,14+,15-,18-/m1/s1 |
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分类
- {SNA} Biochemicals and Reagents, Enzyme Inhibitors, Enzyme Inhibitors by Type, Enzymes, Inhibitors, and Substrates, Substrate Analogs
- {SNA} Biochemicals and Reagents, Enzyme Inhibitors, Enzyme Inhibitors by Type, Substrate Analogs, 酶、抑制剂和底物
- {SNA} Enzyme Inhibitors, Enzyme Inhibitors by Type, Substrate Analogs, 生化试剂, 酶、抑制剂和底物
安全信息
GHS Symbol
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P264+P265
- P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
- 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。
- P302+P352
- P304+P340
- P305+P351+P338
- P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
- P319
- P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
- P332+P313
- P332+P317
- P337+P313
- P337+P317
- P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
- P362+P364
- P403+P233
- P405 Store locked up. 上锁保管。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- H315 Causes skin irritation 会刺激皮肤
- 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
- 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；
- S36 Wear suitable protective clothing 穿戴适当的防护服；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
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