Chemical Compound

3-[43,49-bis(4-aminobutyl)-22,64,76,88-tetrakis(butan-2-yl)-31-(3-carbamimidamidopropyl)-28-(carbamoylmethyl)-4,46,55,70,73-pentakis(hydroxymethyl)-34-[(4-hydroxyphenyl)methyl]-91-[(1H-indol-3-yl)methyl]-67-methyl-3,6,9,12,15,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,87,90,93,96-triacontaoxo-40,94-bis(propan-2-yl)-98,99,102,103,106,107-hexathia-2,5,8,11,14,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80,86,89,92,95-triacontaazahexacyclo[50.44.4.413,58.437,79.016,20.082,86]108n-7-yl]propanoic acid

3-[43,49-bis(4-aminobutyl)-22,64,76,88-tetrakis(butan-2-yl)-31-(3-carbamimidamidopropyl)-28-(carbamoylmethyl)-4,46,55,70,73-pentakis(hydroxymethyl)-34-[(4-hydroxyphenyl)methyl]-91-[(1H-indol-3-yl)methyl]-67-methyl-3,6,9,12,15,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,87,90,93,96-triacontaoxo-40,94-bis(propan-2-yl)-98,99,102,103,106,107-hexathia-2,5,8,11,14,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80,86,89,92,95-triacontaazahexacyclo[50.44.4.413,58.437,79.016,20.082,86]108n-7-yl]propanoic acid 结构式
Primary record

3-[43,49-bis(4-aminobutyl)-22,64,76,88-tetrakis(butan-2-yl)-31-(3-carbamimidamidopropyl)-28-(carbamoylmethyl)-4,46,55,70,73-pentakis(hydroxymethyl)-34-[(4-hydroxyphenyl)methyl]-91-[(1H-indol-3-yl)methyl]-67-methyl-3,6,9,12,15,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,87,90,93,96-triacontaoxo-40,94-bis(propan-2-yl)-98,99,102,103,106,107-hexathia-2,5,8,11,14,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80,86,89,92,95-triacontaazahexacyclo[50.44.4.413,58.437,79.016,20.082,86]108n-7-yl]propanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
139033098
SMILES
CCC(C)C1C(=O)NCC(=O)NC2CSSCC3C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC4CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C)CO)CO)C(C)CC)NC(=O)C5CCCN5C(=O)C(NC(=O)C(NC(=O)C(NC4=O)C(C)C)CC6=CNC7=CC=CC=C76)C(C)CC)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N8CCCC8C(=O)N3)C(C)CC)CC(=O)N)CCCNC(=N)N)CC9=CC=C(C=C9)O)C(C)C)CCCCN)CO)CCCCN)NC(=O)C(NC2=O)CO)CO)CCC(=O)O
Canonical SMILES
CCC(C)C1NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CO)NC(=O)C(C(C)CC)NC(=O)C2CSSCC3NC(=O)C(C(C)C)NC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)C(CCCCN)NC(=O)C4CSSCC(NC(=O)C(CO)NC(=O)C(CCC(=O)O)NC(=O)CNC(=O)C(CSSCC(NC(=O)CNC1=O)C(=O)NC(CO)C(=O)N4)NC(=O)C1CCCN1C(=O)C(C(C)CC)NC(=O)CNC(=O)C(CC(N)=O)NC(=O)C(CCCNC(=N)N)NC(=O)C(Cc1ccc(O)cc1)NC3=O)C(=O)NC(C(C)C)C(=O)NC(Cc1c[nH]c3ccccc13)C(=O)NC(C(C)CC)C(=O)N1CCCC1C(=O)N2

名称与同义词

  • CycloviolacinO2
  • cycloviolacin O2
  • J2.881.913G
  • Q27280731
  • 3-[43,49-bis(4-aminobutyl)-22,64,76,88-tetrakis(butan-2-yl)-31-(3-carbamimidamidopropyl)-28-(carbamoylmethyl)-4,46,55,70,73-pentakis(hydroxymethyl)-34-[(4-hydroxyphenyl)methyl]-91-[(1H-indol-3-yl)methyl]-67-methyl-3,6,9,12,15,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,87,90,93,96-triacontaoxo-40,94-bis(propan-2-yl)-98,99,102,103,106,107-hexathia-2,5,8,11,14,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80,86,89,92,95-triacontaazahexacyclo[50.44.4.413,58.437,79.016,20.082,86]108n-7-yl]propanoic acid
  • Cyclo[Gly-L-Ile-L-Pro-L-Cys(1)-Gly-L-Glu-L-Ser-L-Cys(2)-L-Val-L-Trp-L-Ile-L-Pro-L-Cys(3)-L-Ile-L-Ser-L-Ser-L-Ala-L-Ile-Gly-L-Cys(1)-L-Ser-L-Cys(2)-L-Lys-L-Ser-L-Lys-L-Val-L-Cys(3)-L-Tyr-L-Arg-L-Asn-]