methyl 2-(3,6-diamino-2-iodo-9H-xanthen-9-yl)benzoate结构式
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常用名 | methyl 2-(3,6-diamino-2-iodo-9H-xanthen-9-yl)benzoate | 英文名 | methyl 2-(3,6-diamino-2-iodo-9H-xanthen-9-yl)benzoate |
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| CAS号 | 109244-59-9 | 分子量 | 472.27600 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C21H17IN2O3 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | methyl 2-(3,6-diamino-2-iodo-9H-xanthen-9-yl)benzoate |
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| 英文别名 | 更多 |
| 分子式 | C21H17IN2O3 |
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| 分子量 | 472.27600 |
| 精确质量 | 472.02800 |
| PSA | 87.57000 |
| LogP | 5.69050 |
| InChIKey | WDKYUDRXMNTUKD-UHFFFAOYSA-N |
| SMILES | COC(=O)c1ccccc1C1c2ccc(N)cc2Oc2cc(N)c(I)cc21 |
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~21%
methyl 2-(3,6-d... 109244-59-9
详细
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| 文献:Journal of Medicinal Chemistry, , vol. 30, # 10 p. 1757 - 1761 |
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~%
methyl 2-(3,6-d... 109244-59-9 |
| 文献:Journal of Medicinal Chemistry, , vol. 30, # 10 p. 1757 - 1761 |
|
~45%
methyl 2-(3,6-d... 109244-59-9 |
| 文献:Journal of Medicinal Chemistry, , vol. 30, # 10 p. 1757 - 1761 |
| 上游产品 2 | |
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| 下游产品 0 | |
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实验名称:Extra cellular concentration of radiolabeled compound was determined in chinese hamst...
来源:ChEMBL
靶标:N/A
External Id:CHEMBL818636
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实验名称:Cellular uptake of radiolabeled compound by chinese hamster lung fibro blasts.
来源:ChEMBL
靶标:N/A
External Id:CHEMBL818635
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实验名称:Ratio of pCi/cell cellular uptake to uCi/mL cellular uptake
来源:ChEMBL
靶标:N/A
External Id:CHEMBL848099
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| Iododihydrorhodamine 123 |
| 2'-iododihydrorhodamine 123 |
| Benzoic acid,2-(3,6-diamino-2-iodo-9H-xanthen-9-yl)-,methyl ester |
| Iodo-reduced Rhodamine 123 |