Chemical Compound

2-(2-{[39,41-bis({[2-(4-bromophenyl)-1-carboxyethyl]carbamoyl}methoxy)-5,11,17,23,29,35-hexa-tert-butyl-38,40,42-trimethoxyheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaen-37-yl]oxy}acetamido)-3-(4-bromophenyl)propanoic acid

2-(2-{[39,41-bis({[2-(4-bromophenyl)-1-carboxyethyl]carbamoyl}methoxy)-5,11,17,23,29,35-hexa-tert-butyl-38,40,42-trimethoxyheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaen-37-yl]oxy}acetamido)-3-(4-bromophenyl)propanoic acid 结构式
Primary record

2-(2-{[39,41-bis({[2-(4-bromophenyl)-1-carboxyethyl]carbamoyl}methoxy)-5,11,17,23,29,35-hexa-tert-butyl-38,40,42-trimethoxyheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaen-37-yl]oxy}acetamido)-3-(4-bromophenyl)propanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177546981
SMILES
CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3OCC(=O)NC(CC4=CC=C(C=C4)Br)C(=O)O)CC5=CC(=CC(=C5OC)CC6=CC(=CC(=C6OCC(=O)NC(CC7=CC=C(C=C7)Br)C(=O)O)CC8=C(C(=CC(=C8)C(C)(C)C)CC9=C(C(=CC(=C9)C(C)(C)C)C2)OCC(=O)NC(CC1=CC=C(C=C1)Br)C(=O)O)OC)C(C)(C)C)C(C)(C)C)C(C)(C)C)OC
Canonical SMILES
COc1c2cc(C(C)(C)C)cc1Cc1cc(C(C)(C)C)cc(c1OCC(=O)NC(Cc1ccc(Br)cc1)C(=O)O)Cc1cc(C(C)(C)C)cc(c1OC)Cc1cc(C(C)(C)C)cc(c1OCC(=O)NC(Cc1ccc(Br)cc1)C(=O)O)Cc1cc(C(C)(C)C)cc(c1OC)Cc1cc(C(C)(C)C)cc(c1OCC(=O)NC(Cc1ccc(Br)cc1)C(=O)O)C2

名称与同义词

  • J2.177.367K
  • 2-(2-{[39,41-bis({[2-(4-bromophenyl)-1-carboxyethyl]carbamoyl}methoxy)-5,11,17,23,29,35-hexa-tert-butyl-38,40,42-trimethoxyheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaen-37-yl]oxy}acetamido)-3-(4-bromophenyl)propanoic acid
  • 37,39,41-Tris[[(alphaS)-alpha-carboxy-4-bromophenethyl]carbamoylmethoxy]-38,40,42-trimethoxy-5,11,17,23,29,35-hexakis-tert-butylheptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaene
  • 5,11,17,23,29,35-Hexatert-butyl-37,39,41-trimethoxy-38,40,42-tris[[[(1S)-1-carboxy-2-(4-bromophenyl)ethyl]carbamoyl]methoxy]heptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecene