Chemical Compound

2-[(1R,4S,10S,16S,19R,22S,25S,31S,34S)-4-(4-aminobutyl)-25-benzyl-34-methyl-2,5,11,14,17,20,23,26,32,35-decaoxo-22-(propan-2-yl)-38,39-dithia-3,6,12,15,18,21,24,27,33,36-decaazatetracyclo[17.17.4.06,10.027,31]tetracontan-16-yl]acetamide

2-[(1R,4S,10S,16S,19R,22S,25S,31S,34S)-4-(4-aminobutyl)-25-benzyl-34-methyl-2,5,11,14,17,20,23,26,32,35-decaoxo-22-(propan-2-yl)-38,39-dithia-3,6,12,15,18,21,24,27,33,36-decaazatetracyclo[17.17.4.06,10.027,31]tetracontan-16-yl]acetamide 结构式
Primary record

2-[(1R,4S,10S,16S,19R,22S,25S,31S,34S)-4-(4-aminobutyl)-25-benzyl-34-methyl-2,5,11,14,17,20,23,26,32,35-decaoxo-22-(propan-2-yl)-38,39-dithia-3,6,12,15,18,21,24,27,33,36-decaazatetracyclo[17.17.4.06,10.027,31]tetracontan-16-yl]acetamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
100975299
SMILES
C[C@H]1C(=O)N[C@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N1)CC4=CC=CC=C4)C(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]5CCCN5C(=O)[C@@H](NC2=O)CCCCN)CC(=O)N
Canonical SMILES
CC(C)[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N2

名称与同义词

  • J1.130.734E
  • Cyclo(L-Asn-L-Cys(1)-L-Val-L-Phe-L-Pro-L-Ala-L-Cys(1)-L-Lys-L-Pro-Gly-)
  • Cyclo(L-Asn-L-Cys(1)-L-Val-L-Phe-L-Pro-L-Ala-L-Cys(1)-L-Lys-L-Pro-L-Gly-)
  • 2-[(1R,4S,10S,16S,19R,22S,25S,31S,34S)-4-(4-aminobutyl)-25-benzyl-34-methyl-2,5,11,14,17,20,23,26,32,35-decaoxo-22-(propan-2-yl)-38,39-dithia-3,6,12,15,18,21,24,27,33,36-decaazatetracyclo[17.17.4.06,10.027,31]tetracontan-16-yl]acetamide