(2Ar,4S,4As,6R,9S,11S,12S,12Ar,12Bs)-12-(Benzoyloxy)-4,9,11-Trihydroxy-4A,8,13,13-Tetramethyl-5-Oxo-2A,3,4,4A,5,6,9,10,11,12,12A,12B-Dodecahydro-1H-7,11-Methanocyclodeca[3,4]Benzo[1,2-B]Oxete-6,12B-Diyl Diacetate (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12-(苯甲酰氧基)-4,9,11-三羟基-4a,8,13,13-四甲基-5-氧代-2a,3,4,4a,5,6,9,10,11,12,12a,12b-十二氢-1H-7,11-甲桥环癸烷并[3,4]苯并[1,2-b]氧杂环丁烯-6,12b-二基二乙酸酯

CAS 27548-93-2 MFCD00153921

化学结构图

27548-93-2
SMILES: CC1(C)C2[C@@H](OC(C)=O)C(=O)[C@@]3(C)[C@H]([C@H](OC(=O)C4C=CC=CC=4)[C@]1(O)C[C@H](O)C=2C)[C@@]1(CO[C@@H]1C[C@@H]3O)OC(C)=O |&1:4,11,13,14,24,27,31,34,36|

化学属性

Mol. FormulaC31H38O11
Mol. Weight587
Melting Point229 -234

别名和识别编码

Chemical Name(2Ar,4S,4As,6R,9S,11S,12S,12Ar,12Bs)-12-(Benzoyloxy)-4,9,11-Trihydroxy-4A,8,13,13-Tetramethyl-5-Oxo-2A,3,4,4A,5,6,9,10,11,12,12A,12B-Dodecahydro-1H-7,11-Methanocyclodeca[3,4]Benzo[1,2-B]Oxete-6,12B-Diyl Diacetate
CAS Number27548-93-2
Synonym 巴卡丁 III (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-6,12b-Bis(acetyloxy)-12-(benzoyloxy)-1,2a,3,4,4a,6,9,10,11,12,12a,12b-dodecahydro-4,9,11-trihydroxy-4a,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca[3,4]benz[1,2-b
MDL NumberMFCD00153921
PubChem Substance ID57653960
Chemical Name Translation(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12-(苯甲酰氧基)-4,9,11-三羟基-4a,8,13,13-四甲基-5-氧代-2a,3,4,4a,5,6,9,10,11,12,12a,12b-十二氢-1H-7,11-甲桥环癸烷并[3,4]苯并[1,2-b]氧杂环丁烯-6,12b-二基二乙酸酯
信息真实价格透明    资金保障    专业采购外包团队在线服务   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
品牌质保精细包装    现货库存    一流品牌服务   

分类

  • Chiral Reagents
  • Heterocycles
  • Pharmaceuticals
  • {SNA} Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Complex Molecules
  • Aromatics
  • Intermediates & Fine Chemicals,

产品应用

  • A precursor to Paclitaxel, a neoplasm inhibitor to ovarian and breast cancers found in Taxus species

相关文献及参考

  • Katkovcinova, Z., et al.: J. Biosci., 63, 721 (2008),
  • Tian, J., et al.: J. Pharm. Sci., 97, 3100 (2008),
  • Miao, Z., et al.: App. Biochem. Microbiol., 45, 81 (2009),

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P308+P313
Hazard statements
  • H350 May cause cancer 可能致癌
  • 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
Signal word Danger
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • 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；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
  • S53 Avoid exposure - obtain special instructions before use 避免接触，使用前获得特别指示说明；
Hazard Codes T
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R45 May cause cancer 可能致癌
  • R46 May cause inheritable genetic damage 可能引起遗传基因损害

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Complex Molecules - Chiral Building Blocks

相关产品推荐