Chemical Compound

(1S,2S,4S,7S,7aR,7a1S,10aS,11aR,13aS,13bR)-1-(benzoyloxy)-4-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-5-methylhexanoyl)oxy)-2-hydroxy-5,7a1,14,14-tetramethyl-9-vinyl-2,3,4,7,7a,7a1,10a,11,11a,13,13a,13b-dodecahydro-1H-8,10,12-trioxa-2,6-methanocyclobuta[b]cyclodeca[de]naphthalene-7,13a-diyl diacetate

CAS Registry Number 849213-15-6
返回搜索 申请报价
(1S,2S,4S,7S,7aR,7a1S,10aS,11aR,13aS,13bR)-1-(benzoyloxy)-4-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-5-methylhexanoyl)oxy)-2-hydroxy-5,7a1,14,14-tetramethyl-9-vinyl-2,3,4,7,7a,7a1,10a,11,11a,13,13a,13b-dodecahydro-1H-8,10,12-trioxa-2,6-methanocyclobuta[b]cyclodeca[de]naphthalene-7,13a-diyl diacetate 结构式
Primary record

(1S,2S,4S,7S,7aR,7a1S,10aS,11aR,13aS,13bR)-1-(benzoyloxy)-4-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-5-methylhexanoyl)oxy)-2-hydroxy-5,7a1,14,14-tetramethyl-9-vinyl-2,3,4,7,7a,7a1,10a,11,11a,13,13a,13b-dodecahydro-1H-8,10,12-trioxa-2,6-methanocyclobuta[b]cyclodeca[de]naphthalene-7,13a-diyl diacetate

库存
6,701 克
纯度
99.4 %
CAS
849213-15-6

化合物标识与属性

CAS
849213-15-6
PubChem CID
11564168
SMILES
CC1=C2[C@@H]([C@H]3[C@@]4([C@H](C[C@@H]5[C@]([C@H]4[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](CC(C)C)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO5)OC(=O)C)OC(O3)C=C)C)OC(=O)C
Canonical SMILES
C=CC1O[C@H]2C[C@H]3OC[C@@]3(OC(C)=O)[C@H]3[C@H](OC(=O)c4ccccc4)[C@]4(O)C[C@H](OC(=O)[C@H](O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(C)=C([C@H](OC(C)=O)[C@H](O1)[C@]23C)C4(C)C

名称与同义词

  • TPI-287
  • TPI 287
  • RefChem:933229
  • Taxane Analogue TPI 287
  • A2VM2V569A
  • 849213-15-6
  • DTXSID50233967
  • orb1740910
  • SCHEMBL10000720
  • DTXCID80156458
  • ACN-035796
  • CID11564168
  • CID 11320454
  • DA-78560
  • HY-126899
  • CS-0108063
  • J3.712.210F
  • Q27273546
  • [(1R,2S,5R,7S,11R,12S,15S,17S,18S,19S)-2,12-Diacetyloxy-9-ethenyl-17-hydroxy-15-[(2R,3S)-2-hydroxy-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]oxy-14,19,20,20-tetramethyl-4,8,10-trioxapentacyclo[9.7.1.113,17.02,5.07,19]icos-13-en-18-yl] benzoate
  • (1S,2S,4S,7S,7aR,7a1S,10aS,11aR,13aS,13bR)-1-(benzoyloxy)-4-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-5-methylhexanoyl)oxy)-2-hydroxy-5,7a1,14,14-tetramethyl-9-vinyl-2,3,4,7,7a,7a1,10a,11,11a,13,13a,13b-dodecahydro-1H-8,10,12-trioxa-2,6-methanocyclobuta[b]cyclodeca[de]naphthalene-7,13a-diyl diacetate
  • (1R,2S,5R,7S,11R,12S,15S,17S,18S,19S)-2,12-bis(acetyloxy)-15-{[(2R,3S)-3-{[(tert-butoxy)carbonyl]amino}-2-hydroxy-5-methylhexanoyl]oxy}-9-ethenyl-17-hydroxy-14,19,20,20-tetramethyl-4,8,10-trioxapentacyclo[9.7.1.113,17.02,5.07,19]icos-13-en-18-yl benzoate
  • (1S,2S,4S,7S,7aR,10aS,11aR,13aS,13bR,13cS)-7,13a-Bis(acetyloxy)-4-({(2R,3S)-3-[(tert-butoxycarbonyl)amino]-2-hydroxy-5-methylhexanoyl}oxy)-9-ethenyl-2-hydroxy-5,13c,14,14-tetramethyl-1,3,4,7,7a,10a,11,11a,13,13a,13b,13c-dodecahydro-2H,9H-2,6-methanocyclodeca[de]oxeto[3,2-g][1,3]benzodioxin-1-yl benzoate
  • (2R,3S)-3-(tert-Butyloxycarbonylamino)-2-hydroxy-5-methylhexanoic acid 4,10alpha-diacetoxy-2alpha-(benzoyloxy)-1-hydroxy-7beta,9alpha-(2-propenylidenebisoxy)-5beta,20-epoxytaxa-11-ene-13alpha-yl ester
  • 7,9-acrolein acetal-10-|A-acetyl-2'(R,S)-hydroxy-3'(S)-isobutyl-3'-(N-t-butoxycarbonyl)-taxane
  • 849213-26-9