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达巴霉素杂质
达巴霉素杂质 / CAS : 102961-72-8
| 外观 | 淡淡的米色粉末 | 危险品编号(UN) | - |
| 海关编码 | 29420000 | 危险品等级 | - |
| 别名 | 达巴霉素盐酸; 抗生素 A40926; 达巴万星前体; 盐酸达巴万星母核; 达巴万星母核; 达尔巴旺辛; 达巴万星杂质 | ||
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RFQ
化学品属性
基本信息
分子式
C71H66Cl2N8O27
分子量
1534.23000
精准质量
1532.34000
PSA
554.16000
Logp
3.60880
IUPAC
6-[[5,32-dichloro-22-(dimethylamino)-52-[3-(dimethylamino)propylcarbamoyl]-2,26,31,44,49-pentahydroxy-21,35,38,54,56,59-hexaoxo-47-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14(63),15,17(62),23(61),24,26,29(60),30,32,41(57),42,44,46(51),47,49,65-henicosaen-64-yl]oxy]-3,4-dihydroxy-5-(9-methyldecanoylamino)oxane-2-carboxylic acid;hydrochloride
异构SMILE
CC(C)CCCCCCCC(=O)NC1C(C(C(OC1OC2=C3C=C4C=C2OC5=C(C=C(C=C5)C(C6C(=O)NC(C7=C(C(=CC(=C7)O)OC8C(C(C(C(O8)CO)O)O)O)C9=C(C=CC(=C9)C(C(=O)N6)NC(=O)C4NC(=O)C1C2=C(C(=CC(=C2)OC2=C(C=CC(=C2)C(C(=O)NC(CC2=CC=C(O3)C=C2)C(=O)N1)N(C)C)O)O)Cl)O)C(=O)NCCCN(C)C)O)Cl)C(=O)O)O)O.Cl
属性分类
物质类别
有机物
所属类目
原料药及其中间体 > 抑制剂
物化性质
密度
1.66±0.1 g/cm3(Predicted)
外观与形状
淡淡的米色粉末
出口信息
HS
29420000
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