Chemical Compound

3-{10,15-Bis[1,2-bis(carboranylcarbonyloxy)ethyl]-20-(2-carboxyethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1<3,6>.1<8,11>.1<13,16>]tetracosa-1,3(22),4,6,8,10,12,14,16(24),17,19-undecaen-4-yl}propanoic acid

3-{10,15-Bis[1,2-bis(carboranylcarbonyloxy)ethyl]-20-(2-carboxyethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1<3,6>.1<8,11>.1<13,16>]tetracosa-1,3(22),4,6,8,10,12,14,16(24),17,19-undecaen-4-yl}propanoic acid 结构式
Primary record

3-{10,15-Bis[1,2-bis(carboranylcarbonyloxy)ethyl]-20-(2-carboxyethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1<3,6>.1<8,11>.1<13,16>]tetracosa-1,3(22),4,6,8,10,12,14,16(24),17,19-undecaen-4-yl}propanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
6335024
SMILES
[B]1[B][B]C([B]1)[B]B(C2[B][B][B][B]2)C(=O)OCC(C3=C(C4=CC5=C(C(=C(N5)C=C6C(=C(C(=N6)C=C7C(=C(C(=N7)C=C3N4)C)CCC(=O)O)CCC(=O)O)C)C)C(COC(=O)B([B]C8[B][B][B][B]8)C9[B][B][B][B]9)OC(=O)B([B]C1[B][B][B][B]1)C1[B][B][B][B]1)C)OC(=O)B([B]C1[B][B][B][B]1)C1[B][B][B][B]1
Canonical SMILES
CC1=C(CCC(=O)O)c2cc3nc(cc4[nH]c(cc5[nH]c(cc1n2)c(C)c5C(COC(=O)B([B]C1[B][B][B][B]1)C1[B][B][B][B]1)OC(=O)B([B]C1[B][B][B][B]1)C1[B][B][B][B]1)c(C)c4C(COC(=O)B([B]C1[B][B][B][B]1)C1[B][B][B][B]1)OC(=O)B([B]C1[B][B][B][B]1)C1[B][B][B][B]1)C(C)=C3CCC(=O)O

名称与同义词

  • Boronated porphyrin
  • AC1O3R0X
  • SCHEMBL30725611
  • OIXRDELXTAXGLF-UHFFFAOYSA-N
  • AIDS085464
  • CID6335024
  • [[1-[7-[1,2-bis[[1
  • 3-[(1Z,4Z,9Z,15Z)-7,12-bis[1,2-bis[[tetraborolan-5-yl(tetraborolan-5-ylboranyl)boranyl]carbonyloxy]ethyl]-18-(2-carboxyethyl)-3,8,13,17-tetramethyl-21,23-dihydroporphyrin-2-yl]propanoic acid
  • 3-{10,15-Bis[1,2-bis(carboranylcarbonyloxy)ethyl]-20-(2-carboxyethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1<3,6>.1<8,11>.1<13,16>]tetracosa-1,3(22),4,6,8,10,12,14,16(24),17,19-undecaen-4-yl}propanoic acid