Chemical Compound

(2aR)-12bbeta-Acetyloxy-12beta-benzoyloxy-1,2abeta,3,4,4a,6,9,10,11,12,12abeta,12b-dodecahydro-4alpha,6alpha,11alpha-trihydroxy-9beta-[[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropanoyl]oxy]-4aalpha,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one

CAS Registry Number 114977-28-5
返回搜索 申请报价
(2aR)-12bbeta-Acetyloxy-12beta-benzoyloxy-1,2abeta,3,4,4a,6,9,10,11,12,12abeta,12b-dodecahydro-4alpha,6alpha,11alpha-trihydroxy-9beta-[[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropanoyl]oxy]-4aalpha,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one 结构式
Primary record

(2aR)-12bbeta-Acetyloxy-12beta-benzoyloxy-1,2abeta,3,4,4a,6,9,10,11,12,12abeta,12b-dodecahydro-4alpha,6alpha,11alpha-trihydroxy-9beta-[[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropanoyl]oxy]-4aalpha,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one

库存
9,522 克
纯度
98.9 %
CAS
114977-28-5

化合物标识与属性

CAS
114977-28-5
PubChem CID
11970251
SMILES
CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O
Canonical SMILES
CC(=O)O[C@@]12CO[C@@H]1C[C@H](O)[C@@]1(C)C(=O)[C@H](O)C3=C(C)[C@@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c4ccccc4)C[C@](O)([C@@H](OC(=O)c4ccccc4)[C@H]21)C3(C)C

名称与同义词

  • docetaxel
  • Docetaxel intermediate
  • Decetaxel
  • Taxotere
  • Docetaxel/
  • Docetaxel (Taxotere)
  • MLS000069455
  • MLS000759480
  • MLS001423968
  • C43H53NO14
  • SCHEMBL5553029
  • 114977-28-5
  • CHEMBL1510899
  • MFCD00800737
  • ZDZOTLJHXYCWBA-BSEPLHNVSA-N
  • HMS2051A12
  • HMS3715N15
  • Docetaxel(Taxotere)/UK 427857
  • ABP000473
  • ABP000761
  • BBL102375
  • STL556176
  • ZINC95546207
  • AKOS017342946
  • AKOS025310078
  • AT-2698
  • CCG-100863
  • NC00113
  • RL00578
  • CID11970251
  • AS-12893
  • SMR000059010
  • AB0007872
  • J384.606G
  • ST24030403
  • J10086
  • 977D285
  • [(1R,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1,9,12-trihydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
  • 114915-14-9
  • 1217445-55-0
  • (1beta,2alpha,5beta,7beta,10beta,13alpha)-4-(acetyloxy)-13-({(2R,3S)-3-[(tert-butoxycarbonyl)amino]-2-hydroxy-3-phenylpropanoyl}oxy)-1,7,10-trihydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate
  • (1R,2S,3R,4S,7R,9S,10S,12R,15S)-4-(acetyloxy)-15-{[(2R,3S)-3-{[(tert-butoxy)carbonyl]amino}-2-hydroxy-3-phenylpropanoyl]oxy}-1,9,12-trihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl benzoate
  • (2aR)-12bbeta-Acetyloxy-12beta-benzoyloxy-1,2abeta,3,4,4a,6,9,10,11,12,12abeta,12b-dodecahydro-4alpha,6alpha,11alpha-trihydroxy-9beta-[[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropanoyl]oxy]-4aalpha,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one
  • (2aR,4S,4aS,6R,9S,11R,12S,12aR,12bS)-12b-acetoxy-9-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-3-phenylpropanoyl)oxy)-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-2a,3,
  • (2aR,4S,4aS,6R,9S,11R,12S,12aR,12bS)-12b-Acetoxy-9-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-3-phenylpropanoyl)oxy)-4,6,11-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]oxet-12-yl benzoate
  • (2aR,4S,4aS,6R,9S,11R,12S,12aR,12bS)-12b-Acetoxy-9-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-3-phenylpropanoyl)oxy)-4,6,11-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]oxet-12-ylbenzoate
  • [(1R,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetoxy-15-[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenyl-propanoyl]oxy-1,9,12-trihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
  • 125354-16-7
  • 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