Chemical Compound

4-[12-(3,5-di-tert-butylphenyl)-7-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]-17-{2-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethynyl}-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]benzoic acid

4-[12-(3,5-di-tert-butylphenyl)-7-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]-17-{2-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethynyl}-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]benzoic acid 结构式
Primary record

4-[12-(3,5-di-tert-butylphenyl)-7-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]-17-{2-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethynyl}-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]benzoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101491577
SMILES
CC(C)(C)C1=CC(=CC(=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC(=CC(=C7)C(C)(C)C)C(C)(C)C)C8=CC(=CC(=C8)C(C)(C)C)C(C)(C)C)C=C4)C#CC9=C1C=CC(=C(C2=NC(=C(C4=CC=C(N4)C(=C4C=CC9=N4)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C4=C5C=CC(=N5)C(=C5C=CC(=C(C6=NC(=C(C7=CC=C4N7)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C=C6)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)N5)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C=C2)C2=CC=C(C=C2)C(=O)O)N1)N3)C(C)(C)C
Canonical SMILES
CC(C)(C)c1cc(-c2c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc([nH]4)c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4nc(c(C#Cc5c6nc(c(-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccc([nH]7)c(-c7c8nc(c(-c9cc(C(C)(C)C)cc(C(C)(C)C)c9)c9ccc([nH]9)c(-c9cc(C(C)(C)C)cc(C(C)(C)C)c9)c9nc(c(-c%10cc(C(C)(C)C)cc(C(C)(C)C)c%10)c%10ccc7[nH]%10)C=C9)C=C8)c7nc(c(-c8ccc(C(=O)O)cc8)c8ccc5[nH]8)C=C7)C=C6)c5ccc2[nH]5)C=C4)C=C3)cc(C(C)(C)C)c1

名称与同义词

  • J2.762.299B
  • 15-[10,15,20-Tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-5-yl]-5-[[5,10,20-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-15-yl]ethynyl]-10-(3,5-di-tert-butylphenyl)-20-(4-carboxyphenyl)-21H,23H-porphyrin
  • 4-[12-(3,5-di-tert-butylphenyl)-7-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]-17-{2-[7,12,17-tris(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]ethynyl}-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]benzoic acid