Chemical Compound

4-[7-(2-{7,17-bis[2,6-bis(octyloxy)phenyl]-12-(4-{bis[4-(hexyloxy)phenyl]amino}phenyl)-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)-2-hexyl-2H-[1,2,3]triazolo[4,5-c]pyridin-4-yl]benzoic acid

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4-[7-(2-{7,17-bis[2,6-bis(octyloxy)phenyl]-12-(4-{bis[4-(hexyloxy)phenyl]amino}phenyl)-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)-2-hexyl-2H-[1,2,3]triazolo[4,5-c]pyridin-4-yl]benzoic acid 结构式
Primary record

4-[7-(2-{7,17-bis[2,6-bis(octyloxy)phenyl]-12-(4-{bis[4-(hexyloxy)phenyl]amino}phenyl)-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)-2-hexyl-2H-[1,2,3]triazolo[4,5-c]pyridin-4-yl]benzoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
132569995
SMILES
CCCCCCCCOC1=C(C(=CC=C1)OCCCCCCCC)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)N(C8=CC=C(C=C8)OCCCCCC)C9=CC=C(C=C9)OCCCCCC)C1=C(C=CC=C1OCCCCCCCC)OCCCCCCCC)C=C4)C#CC1=CN=C(C2=NN(N=C12)CCCCCC)C1=CC=C(C=C1)C(=O)O)N3
Canonical SMILES
CCCCCCCCOc1cccc(OCCCCCCCC)c1-c1c2nc(c(-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)c3ccc([nH]3)c(-c3c(OCCCCCCCC)cccc3OCCCCCCCC)c3nc(c(C#Cc4cnc(-c5ccc(C(=O)O)cc5)c5nn(CCCCCC)nc45)c4ccc1[nH]4)C=C3)C=C2

名称与同义词

  • J3.640.205I
  • 4-[7-(2-{7,17-bis[2,6-bis(octyloxy)phenyl]-12-(4-{bis[4-(hexyloxy)phenyl]amino}phenyl)-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)-2-hexyl-2H-[1,2,3]triazolo[4,5-c]pyridin-4-yl]benzoic acid
  • 4-[7-[5-[4-[Bis[4-(hexyloxy)phenyl]amino]phenyl]-10,20-bis[2,6-bis(octyloxy)phenyl]-21H,23H-porphyrin-15-ylethynyl]-2-hexyl-2H-1,2,3-triazolo[4,5-c]pyridine-4-yl]benzoic acid