CAS: 90332-65-3; (2Ar,4S,4As,6R,9S,11S,12S,12Ar,12Bs)-12B-Acetoxy-9-(((2R,3S)-3-Hexanamido-2-Hydroxy-3-Phenylpropanoyl)Oxy)-6,11-Dihydroxy-4A,8,13,13-Tetramethyl-5-Oxo-4-(((2S,3R,4S,5R)-3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Oxy)-2A,3,4,4A,5,6,9,10,11,12,12A,12B-Dodecahydro-1H-7,11-Methanocyclodeca[3,4]Benzo[1,2-B]Oxet-12-Yl Benzoate

• 英文名称(2Ar,4S,4As,6R,9S,11S,12S,12Ar,12Bs)-12B-Acetoxy-9-(((2R,3S)-3-Hexanamido-2-Hydroxy-3-Phenylpropanoyl)Oxy)-6,11-Dihydroxy-4A,8,13,13-Tetramethyl-5-Oxo-4-(((2S,3R,4S,5R)-3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Oxy)-2A,3,4,4A,5,6,9,10,11,12,12A,12B-Dodecahydro-1H-7,11-Methanocyclodeca[3,4]Benzo[1,2-B]Oxet-12-Yl Benzoate
• 中文名称7-木糖苷-10-脱乙酰基紫杉醇
• IUPAC名称(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-acetoxy-9-(((2R,3S)-3-hexanamido-2-hydroxy-3-phenylpropanoyl)oxy)-6,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-4-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxet-12-yl benzoate
• 其它别名10-Deacetyl-7-Xylosylpaclitaxel; Deacetyl-7-Xylosyltaxol C, 10-(P); 7-Xylosyl-10-Deacetyltaxol C; 10-Deacetyltaxol C 7-Xyloside; 7-(Beta-Xylosyl)-10-Deacetyltaxol C; 10-Deacetyl-7-Xylosyltaxol C; [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-Acetyloxy-15-[(2R,3S)-3-(Hexanoylamino)-2-Hydroxy-3-Phenylpropanoyl]Oxy-1,12-Dihydroxy-10,14,17,17-Tetramethyl-11-Oxo-9-[(2S,3R,4S,5R)-3,4,5-Trihydroxyoxan-2-Yl]Oxy-6-Oxatetracyclo[11.3.1.0^{3,10}.0^{4,7}]Heptadec-13-En-2-Yl] Benzoate; Benzenepropanoic Acid, α-Hydroxy-β-[(1-Oxohexyl)Amino]-, (2Ar,4S,4As,6R,9S,11S,12S,12Ar,12Bs)-12B-(Acetyloxy)-12-(Benzoyloxy)-2A,3,4,4A,5,6,9,10,11,12,12A,12B-Dodecahydro-6,11-Dihydroxy-4A,8,13,13-Tetramethyl-5-Oxo-4-(β-D-Xylopyranosyloxy)-7,11-Methano-1H-Cyclodeca[3,4]Benz[1,2-B]Oxet-9-Yl Ester, (α...
• CAS编号90332-65-3
• MFCD编号:MFCD12031378
• 分子式:C49H63NO17分子量:938.03
• 产品CID: 1935798
• 产品分类天然产物 → 萜类

• 相似结构搜索
• 产品信息参考;;;;
• InChIKey: XGWGQEYABFGJID-UVDBIDMBSA-N
• InChI=1S/C49H63NO17/c1-7-8-11-20-33(53)50-35(27-16-12-9-13-17-27)38(56)44(60)64-30-22-49(61)42(66-43(59)28-18-14-10-15-19-28)40-47(6,41(58)37(55)34(25(30)2)46(49,4)5)31(2
• 计算化学: 氢键受体数17.0氢键供体数7.0可旋转键数17.0

物理性质

• 沸点1042.1±65.0 °C(预测)
• 闪点596.3±34.3 °C
• 密度1.41±0.1 g/cm3(预测)
• pKa:11.26±0.70(预测)
• PSA:274.14
• LogP:2.2856
• 产品应用该化合物用于该化合物用于使用10-DEACETY-7-XYLOXYLTAXANE的10-DEAXYETYTER-XEXAGAIN.

MSDS等安全信息

• 危险描述H303 May be harmful if swallowed+H313 Skin contact may be harmful+H333 Inhalation may be harmful to the body
• 防范说明P264+P280+P305+P351+P338+P337+P313
• 安全声明H303+H313+H333

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海关参考信息

• 2901210000-乙烯
  2901220000-丙烯
  2902600000-乙苯
  2905122000-异丙醇
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• 详情请参考：📖 海关编码查询和海关进出口税则

其他信息查阅

• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管