Chemical Compound

methyl 3-[(4S,5S)-10-ethenyl-15-ethyl-20-[(3-{3-[(21S,22S)-11-ethyl-16-[1-(hexyloxy)ethyl]-12,17,21,26-tetramethyl-4-oxo-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]propanamido}propyl)carbamoyl]-2-(2-methoxy-2-oxoethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(21),2,6,8(23),9,11,13,15,17,19-decaen-4-yl]propanoate

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methyl 3-[(4S,5S)-10-ethenyl-15-ethyl-20-[(3-{3-[(21S,22S)-11-ethyl-16-[1-(hexyloxy)ethyl]-12,17,21,26-tetramethyl-4-oxo-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]propanamido}propyl)carbamoyl]-2-(2-methoxy-2-oxoethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(21),2,6,8(23),9,11,13,15,17,19-decaen-4-yl]propanoate 结构式
Primary record

methyl 3-[(4S,5S)-10-ethenyl-15-ethyl-20-[(3-{3-[(21S,22S)-11-ethyl-16-[1-(hexyloxy)ethyl]-12,17,21,26-tetramethyl-4-oxo-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]propanamido}propyl)carbamoyl]-2-(2-methoxy-2-oxoethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(21),2,6,8(23),9,11,13,15,17,19-decaen-4-yl]propanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177586213
SMILES
CCCCCCOC(C)C1=C(C2=NC1=CC3=NC(=CC4=C(C5=C(CC(=C6[C@H]([C@@H](C(=C2)N6)C)CCC(=O)NCCCNC(=O)C7=C8C(=C9[C@H]([C@@H](C(=N9)C=C1C(=C(C(=CC2=NC(=CC(=C7C)N8)C(=C2C)CC)N1)C=C)C)C)CCC(=O)OC)CC(=O)OC)C5=N4)O)C)C(=C3C)CC)C
Canonical SMILES
C=Cc1c(C)c2cc3nc(c(CC(=O)OC)c4[nH]c(cc5nc(cc1[nH]2)C(C)=C5CC)c(C)c4C(=O)NCCCNC(=O)CC[C@@H]1C2=C4CC(O)=C5C4=NC(=C5C)C=C4N=C(C=C5N=C(C=C(N2)[C@H]1C)C(C)=C5C(C)OCCCCCC)C(C)=C4CC)[C@@H](CCC(=O)OC)[C@@H]3C

名称与同义词

  • J1.381.351E
  • (2S)-18-[[3-[[3-[(17S)-21-Oxo-3,8,13,17beta-tetramethyl-7-ethyl-12-[1-(hexyloxy)ethyl]-21,22,17,18-tetrahydro-21H,23H-cyclopenta[at]porphyrin-18alpha-yl]propionyl]amino]propyl]carbamoyl]-20-[(methoxycarbonyl)methyl]-8-ethenyl-13-ethyl-2,3-dihydro-3alpha,7,12,17-tetramethyl-21H,23H-porphyrin-2beta-propionic acid methyl ester
  • methyl 3-[(4S,5S)-10-ethenyl-15-ethyl-20-[(3-{3-[(21S,22S)-11-ethyl-16-[1-(hexyloxy)ethyl]-12,17,21,26-tetramethyl-4-oxo-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]propanamido}propyl)carbamoyl]-2-(2-methoxy-2-oxoethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(21),2,6,8(23),9,11,13,15,17,19-decaen-4-yl]propanoate