Chemical Compound

2-[(3S,6S,9S,12S,15S,18S,21S,26aS)-15-(4-aminobutyl)-9-benzyl-3,21-bis[(4-hydroxyphenyl)methyl]-12-[(1H-indol-3-yl)methyl]-1,4,7,10,13,16,19,22-octaoxo-18-(propan-2-yl)-hexacosahydropyrrolo[1,2-a]1,4,7,10,13,16,19,22-octaazacyclotetracosan-6-yl]acetic acid

2-[(3S,6S,9S,12S,15S,18S,21S,26aS)-15-(4-aminobutyl)-9-benzyl-3,21-bis[(4-hydroxyphenyl)methyl]-12-[(1H-indol-3-yl)methyl]-1,4,7,10,13,16,19,22-octaoxo-18-(propan-2-yl)-hexacosahydropyrrolo[1,2-a]1,4,7,10,13,16,19,22-octaazacyclotetracosan-6-yl]acetic acid 结构式
Primary record

2-[(3S,6S,9S,12S,15S,18S,21S,26aS)-15-(4-aminobutyl)-9-benzyl-3,21-bis[(4-hydroxyphenyl)methyl]-12-[(1H-indol-3-yl)methyl]-1,4,7,10,13,16,19,22-octaoxo-18-(propan-2-yl)-hexacosahydropyrrolo[1,2-a]1,4,7,10,13,16,19,22-octaazacyclotetracosan-6-yl]acetic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
10396390
SMILES
CC(C)[C@H]1C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCN)CC3=CNC4=CC=CC=C43)CC5=CC=CC=C5)CC(=O)O)CC6=CC=C(C=C6)O)CC7=CC=C(C=C7)O
Canonical SMILES
CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC1=O

名称与同义词

  • Hymenamide J
  • CID10396390
  • CID 10396390
  • J713.858J
  • Cyclo(L-Pro-L-Tyr-L-Asp-L-Phe-L-Trp-L-Lys-L-Val-L-Tyr-)
  • Cyclo[L-Tyr-L-Asp-L-Phe-L-Trp-L-Lys-L-Val-L-Tyr-L-Pro-]
  • 2-[(3S,6S,9S,12S,15S,18S,21S,26aS)-15-(4-aminobutyl)-9-benzyl-3,21-bis[(4-hydroxyphenyl)methyl]-12-[(1H-indol-3-yl)methyl]-1,4,7,10,13,16,19,22-octaoxo-18-(propan-2-yl)-hexacosahydropyrrolo[1,2-a]1,4,7,10,13,16,19,22-octaazacyclotetracosan-6-yl]acetic acid