Chemical Compound

methyl 4-{20-[4-(methoxycarbonyl)phenyl]-37,38,39,40-tetraazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),10,12,18,20,22(27),28(38),29,31(36)-undecaen-2-yl}benzoate

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methyl 4-{20-[4-(methoxycarbonyl)phenyl]-37,38,39,40-tetraazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),10,12,18,20,22(27),28(38),29,31(36)-undecaen-2-yl}benzoate 结构式
Primary record

methyl 4-{20-[4-(methoxycarbonyl)phenyl]-37,38,39,40-tetraazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),10,12,18,20,22(27),28(38),29,31(36)-undecaen-2-yl}benzoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
136391779
SMILES
COC(=O)C1=CC=C(C=C1)C2=C3C4=C(CCCC4)C(=CC5=NC(=C(C6=C7CCCCC7=C(N6)C=C8C9=C(C2=N8)CCCC9)C1=CC=C(C=C1)C(=O)OC)C1=C5CCCC1)N3
Canonical SMILES
COC(=O)c1ccc(-c2c3nc(cc4[nH]c(c5c4CCCC5)c(-c4ccc(C(=O)OC)cc4)c4nc(cc5[nH]c2c2c5CCCC2)C2=C4CCCC2)C2=C3CCCC2)cc1

名称与同义词

  • SCHEMBL469823
  • J2.607.181J
  • 4,4 -(21,22,23,24,71,72,73,74,121,122,123,124,171,172,173,174-Hexadecahydro-21H,23H-tetrabenzo[b,g,l,q]porphyrin-5,15-diyl)bis(benzoic acid methyl) ester
  • 5,15-Bis[4-(methoxycarbonyl)phenyl]-21,22,23,24,71,72,73,74,121,122,123,124,171,172,173,174-hexadecahydro-21H,23H-tetrabenzo[b,g,l,q]porphyrin
  • methyl 4-{20-[4-(methoxycarbonyl)phenyl]-37,38,39,40-tetraazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),10,12,18,20,22(27),28(38),29,31(36)-undecaen-2-yl}benzoate