Chemical Compound

methyl 3-(1-{2-[7-(2-{4-[2-(cyclopenta-2,4-dien-1-yl)ethynyl]-1H-1,2,3-triazol-1-yl}phenyl)-12,17-bis({2-[4-(3-methoxy-3-oxoprop-1-yn-1-yl)-1H-1,2,3-triazol-1-yl]phenyl})-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]phenyl}-1H-1,2,3-triazol-4-yl)prop-2-ynoate

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methyl 3-(1-{2-[7-(2-{4-[2-(cyclopenta-2,4-dien-1-yl)ethynyl]-1H-1,2,3-triazol-1-yl}phenyl)-12,17-bis({2-[4-(3-methoxy-3-oxoprop-1-yn-1-yl)-1H-1,2,3-triazol-1-yl]phenyl})-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]phenyl}-1H-1,2,3-triazol-4-yl)prop-2-ynoate 结构式
Primary record

methyl 3-(1-{2-[7-(2-{4-[2-(cyclopenta-2,4-dien-1-yl)ethynyl]-1H-1,2,3-triazol-1-yl}phenyl)-12,17-bis({2-[4-(3-methoxy-3-oxoprop-1-yn-1-yl)-1H-1,2,3-triazol-1-yl]phenyl})-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]phenyl}-1H-1,2,3-triazol-4-yl)prop-2-ynoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102491141
SMILES
COC(=O)C#CC1=CN(N=N1)C2=CC=CC=C2C3=C4C=CC(=C(C5=NC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC=CC=C8N9C=C(N=N9)C#CC(=O)OC)C1=CC=CC=C1N1C=C(N=N1)C#CC(=O)OC)C=C5)C1=CC=CC=C1N1C=C(N=N1)C#CC1C=CC=C1)N4
Canonical SMILES
COC(=O)C#Cc1cn(-c2ccccc2-c2c3nc(c(-c4ccccc4-n4cc(C#CC(=O)OC)nn4)c4ccc([nH]4)c(-c4ccccc4-n4cc(C#CC5C=CC=C5)nn4)c4nc(c(-c5ccccc5-n5cc(C#CC(=O)OC)nn5)c5ccc2[nH]5)C=C4)C=C3)nn1

名称与同义词

  • J3.151.544K
  • 3,3 ,3 -[20-[2-[4-(2,4-Cyclopentadienylethynyl)-1H-1,2,3-triazole-1-yl]phenyl]-21H,23H-porphyrin-5,10,15-triyltris[2,1-phenylene(1H-1,2,3-triazole-1,4-diyl)]]tris(propiolic acid methyl) ester
  • methyl 3-(1-{2-[7-(2-{4-[2-(cyclopenta-2,4-dien-1-yl)ethynyl]-1H-1,2,3-triazol-1-yl}phenyl)-12,17-bis({2-[4-(3-methoxy-3-oxoprop-1-yn-1-yl)-1H-1,2,3-triazol-1-yl]phenyl})-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]phenyl}-1H-1,2,3-triazol-4-yl)prop-2-ynoate