Chemical Compound

Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, (2aR,4R,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (aR,ssS)-; Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, 12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, [2aR-[2aa,4a,4ass,6ss,9a(aR*,ssS*),11ss,12a,12aa,12ba]]-; 7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete, benzenepropanoic acid deriv.; 4-epi-Docetaxel; 7-Epidocetaxel; 7-Epitaxotere; 7-epi-Docetaxel; 5ss,20-epoxy-1,7a,10ss-Trihydroxy-9-oxotax-11-ene-2a,4,13a-triyl 4-acetate 2-benzoate 13-[(2R,3S)-3-[[(1,1-dimethylethoxy)carbonyl]amin

CAS Registry Number 153381-68-1
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Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, (2aR,4R,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (aR,ssS)-; Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, 12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, [2aR-[2aa,4a,4ass,6ss,9a(aR*,ssS*),11ss,12a,12aa,12ba]]-; 7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete, benzenepropanoic acid deriv.; 4-epi-Docetaxel; 7-Epidocetaxel; 7-Epitaxotere; 7-epi-Docetaxel; 5ss,20-epoxy-1,7a,10ss-Trihydroxy-9-oxotax-11-ene-2a,4,13a-triyl 4-acetate 2-benzoate 13-[(2R,3S)-3-[[(1,1-dimethylethoxy)carbonyl]amin 结构式
Primary record

Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, (2aR,4R,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (aR,ssS)-; Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, 12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, [2aR-[2aa,4a,4ass,6ss,9a(aR*,ssS*),11ss,12a,12aa,12ba]]-; 7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete, benzenepropanoic acid deriv.; 4-epi-Docetaxel; 7-Epidocetaxel; 7-Epitaxotere; 7-epi-Docetaxel; 5ss,20-epoxy-1,7a,10ss-Trihydroxy-9-oxotax-11-ene-2a,4,13a-triyl 4-acetate 2-benzoate 13-[(2R,3S)-3-[[(1,1-dimethylethoxy)carbonyl]amin

库存
4,495 克
纯度
99.3 %
CAS
153381-68-1

化合物标识与属性

CAS
153381-68-1
PubChem CID
58510442
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

  • 7-EPI-DOCETAXEL
  • 4-Epidocetaxel
  • 7-Epidocetaxel
  • 7-Epitaxotere
  • 7-Epi Docetaxel
  • 4-epi-Docetaxel
  • Docetaxel Impurity C
  • 153381-68-1
  • Docetaxel EP Impurity C
  • BVQ8BYC7MI
  • UNII-BVQ8BYC7MI
  • RefChem:98810
  • 4-epi-Docetaxel (USP)
  • 7-Epi-docetaxel (Docetaxel Impurity C)
  • DTXSID30165318
  • Docetaxel trihydrate impurity C
  • C43H53NO14
  • Docetaxel trihydrate impurity C [EP]
  • orb1679010
  • DTXCID1087809
  • SCHEMBL12127075
  • Docetaxel Impurity C (7-Epi-Docetaxel)
  • ZDZOTLJHXYCWBA-MQOKZWAMSA-N
  • 3392AH
  • EX-A11263
  • MFCD15071206
  • ZINC94303280
  • CS-3194
  • Docetaxel impurity, 4-epidocetaxel- [USP]
  • Docetaxel trihydrate specified impurity C [EP]
  • Docetaxel trihydrate specified impurity C
  • 4-epi-Docetaxel;7-Epidocetaxel;7-Epitaxotere
  • AS-82482
  • DA-60565
  • Docetaxel impurity, 4-epidocetaxel-(USP)
  • Docetaxel impurity, 4-epidocetaxel-[USP]
  • HY-16676
  • PD101293
  • FT-0667887
  • DOCETAXEL TRIHYDRATE IMPURITY C [EP IMPURITY]
  • A899298
  • F987615
  • DOCETAXEL TRIHYDRATE IMPURITY C (EP IMPURITY)
  • Q27274912
  • [(1S,2S,3R,4S,7R,9R,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
  • DOCETAXEL IMPURITY, 4-EPIDOCETAXEL- [USP IMPURITY]
  • DOCETAXEL IMPURITY, 4-EPIDOCETAXEL-(USP IMPURITY)
  • DOCETAXEL IMPURITY, 4-EPIDOCETAXEL-[USP IMPURITY]
  • 5beta,20-Epoxy-1,7alpha,10beta-trihydroxy-9-oxotax-11-ene-2alpha,4,13alpha-triyl 4-acetate 2-benzoate 13-((2R,3S)-3-(((1,1-dimethylethoxy)carbonyl)amino)-2-hydroxy-3-phenylpropanoate)
  • (2b,5b,7a,10b,13a)-4-Acetoxy-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
  • 5.BETA.,20-EPOXY-1,7.ALPHA.,10.BETA.-TRIHYDROXY-9-OXOTAX-11-ENE-2.ALPHA.,4,13.ALPHA.-TRIYL 4-ACETATE 2-BENZOATE 13-((2R,3S)-3-(((1,1-DIMETHYLETHOXY)CARBONYL)AMINO)-2-HYDROXY-3-PHENYLPROPANOATE)
  • (2aR,4R,4aS,6R,9S,11S,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
  • (3S,4aS,5R,6S)-3-Methoxy-1-oxo-5-vinyl-4,4a,5,6-tetrahydro-1H,3H- pyrano[3,4-c]pyran-6-yl |A-D-glucopyranoside
  • [(1S,2S,3R,4S,7R,9R,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
  • 118627-52-4
  • 4-(Acetyloxy)-13alpha-({(2R,3S)-3-[(tert-butoxycarbonyl)amino]-2-hydroxy-3-phenylpropanoyl}oxy)-1,7alpha,10beta-trihydroxy-9-oxo-4alpha,5beta-5,20-epoxytax-11-en-2alpha-yl benzoate
  • Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, (2aR,4R,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, (aR,ssS)-; Benzenepropanoic acid, ss-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, 12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester, [2aR-[2aa,4a,4ass,6ss,9a(aR*,ssS*),11ss,12a,12aa,12ba]]-; 7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete, benzenepropanoic acid deriv.; 4-epi-Docetaxel; 7-Epidocetaxel; 7-Epitaxotere; 7-epi-Docetaxel; 5ss,20-epoxy-1,7a,10ss-Trihydroxy-9-oxotax-11-ene-2a,4,13a-triyl 4-acetate 2-benzoate 13-[(2R,3S)-3-[[(1,1-dimethylethoxy)carbonyl]amin