Chemical Compound

methyl 3-[(21S,22S)-11-ethyl-12,17,21,26-tetramethyl-4-oxo-16-{5,9,15,19-tetrabutyl-4,10,14,20-tetramethyl-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}-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10(25),11,13,15,17,19-decaen-22-yl]propanoate

methyl 3-[(21S,22S)-11-ethyl-12,17,21,26-tetramethyl-4-oxo-16-{5,9,15,19-tetrabutyl-4,10,14,20-tetramethyl-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}-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10(25),11,13,15,17,19-decaen-22-yl]propanoate 结构式
Primary record

methyl 3-[(21S,22S)-11-ethyl-12,17,21,26-tetramethyl-4-oxo-16-{5,9,15,19-tetrabutyl-4,10,14,20-tetramethyl-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}-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10(25),11,13,15,17,19-decaen-22-yl]propanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
136803259
SMILES
CCCCC1=C(C2=CC3=NC(=CC4=C(C(=C(N4)C(=C5C(=C(C(=N5)C=C1N2)CCCC)C)C6=C(C7=CC8=NC(=C9CC(=O)C1=C9NC(=C1C)C=C1C(=C(C(=N1)C=C6N7)C)CC)[C@H]([C@@H]8C)CCC(=O)OC)C)C)CCCC)C(=C3C)CCCC)C
Canonical SMILES
CCCCC1=C(C)c2cc3[nH]c(cc4nc(c(-c5c(C)c6cc7nc(c8c9[nH]c(cc%10nc(cc5[nH]6)C(C)=C%10CC)c(C)c9C(=O)C8)[C@@H](CCC(=O)OC)[C@@H]7C)c5[nH]c(cc1n2)c(CCCC)c5C)C(C)=C4CCCC)c(CCCC)c3C

名称与同义词

  • J820.056D
  • 2,8alpha,12,17-Tetramethyl-13-(2,8,12,18-tetramethyl-3,7,13,17-tetrabutyl-21H,23H-porphyrin-10-yl)-18-ethyl-26-oxo-7,8-dihydro-3,5-ethano-21H,23H-porphyrin-7beta-propionic acid methyl ester
  • methyl 3-[(21S,22S)-11-ethyl-12,17,21,26-tetramethyl-4-oxo-16-{5,9,15,19-tetrabutyl-4,10,14,20-tetramethyl-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}-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10(25),11,13,15,17,19-decaen-22-yl]propanoate