Chemical Compound

55-[2-(2-amino-3-phenylpropanamido)-3-phenylpropanamido]-46,69-dibenzyl-10,81-bis(3-carbamimidamidopropyl)-13-(carbamoylmethyl)-28,78,91-tris(carboxymethyl)-75-(1-hydroxyethyl)-63-(hydroxymethyl)-66-(2-methanesulfinylethyl)-37-methyl-34-(2-methylpropyl)-3,9,12,15,21,24,27,30,33,36,39,42,45,48,54,62,65,68,71,74,77,80,83,90,93-pentacosaoxo-31-(propan-2-yl)-57,58,85,86,95,96-hexathia-2,8,11,14,20,23,26,29,32,35,38,41,44,47,53,61,64,67,70,73,76,79,82,89,92-pentacosaazahexacyclo[58.23.10.425,40.04,8.016,20.049,53]heptanonacontane-88-carboxylic acid

55-[2-(2-amino-3-phenylpropanamido)-3-phenylpropanamido]-46,69-dibenzyl-10,81-bis(3-carbamimidamidopropyl)-13-(carbamoylmethyl)-28,78,91-tris(carboxymethyl)-75-(1-hydroxyethyl)-63-(hydroxymethyl)-66-(2-methanesulfinylethyl)-37-methyl-34-(2-methylpropyl)-3,9,12,15,21,24,27,30,33,36,39,42,45,48,54,62,65,68,71,74,77,80,83,90,93-pentacosaoxo-31-(propan-2-yl)-57,58,85,86,95,96-hexathia-2,8,11,14,20,23,26,29,32,35,38,41,44,47,53,61,64,67,70,73,76,79,82,89,92-pentacosaazahexacyclo[58.23.10.425,40.04,8.016,20.049,53]heptanonacontane-88-carboxylic acid 结构式
Primary record

55-[2-(2-amino-3-phenylpropanamido)-3-phenylpropanamido]-46,69-dibenzyl-10,81-bis(3-carbamimidamidopropyl)-13-(carbamoylmethyl)-28,78,91-tris(carboxymethyl)-75-(1-hydroxyethyl)-63-(hydroxymethyl)-66-(2-methanesulfinylethyl)-37-methyl-34-(2-methylpropyl)-3,9,12,15,21,24,27,30,33,36,39,42,45,48,54,62,65,68,71,74,77,80,83,90,93-pentacosaoxo-31-(propan-2-yl)-57,58,85,86,95,96-hexathia-2,8,11,14,20,23,26,29,32,35,38,41,44,47,53,61,64,67,70,73,76,79,82,89,92-pentacosaazahexacyclo[58.23.10.425,40.04,8.016,20.049,53]heptanonacontane-88-carboxylic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177410487
SMILES
CC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC2CSSCC(C(=O)N1)NC(=O)CNC(=O)C(NC(=O)C3CCCN3C(=O)C(CSSCC4C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)N4)CO)CCS(=O)C)CC5=CC=CC=C5)C(C)O)CC(=O)O)CCCNC(=N)N)NC(=O)C6CCCN6C(=O)C(NC(=O)C(NC(=O)C7CCCN7C(=O)CNC2=O)CC(=O)N)CCCNC(=N)N)C(=O)O)CC(=O)O)NC(=O)C(CC8=CC=CC=C8)NC(=O)C(CC9=CC=CC=C9)N)CC1=CC=CC=C1)CC(=O)O)C(C)C)CC(C)C
Canonical SMILES
CC(C)CC1NC(=O)C(C)NC(=O)C2CSSCC(NC(=O)C(CC(=O)O)NC(=O)C(C(C)C)NC1=O)C(=O)NCC(=O)N1CCCC1C(=O)NC(CC(N)=O)C(=O)NC(CCCNC(=N)N)C(=O)N1CCCC1C(=O)NC1CSSCC(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CSSCC(NC(=O)C(Cc3ccccc3)NC(=O)C(N)Cc3ccccc3)C(=O)N3CCCC3C(=O)NC(Cc3ccccc3)C(=O)NCC(=O)N2)NC(=O)C(CO)NC(=O)C(CCS(C)=O)NC(=O)C(Cc2ccccc2)NC(=O)CNC(=O)C(C(C)O)NC(=O)C(CC(=O)O)NC(=O)C(CCCNC(=N)N)NC1=O

名称与同义词

  • Neopetrosiamide A
  • Neopetrosiamide B
  • J2.230.097K
  • 55-[2-(2-amino-3-phenylpropanamido)-3-phenylpropanamido]-46,69-dibenzyl-10,81-bis(3-carbamimidamidopropyl)-13-(carbamoylmethyl)-28,78,91-tris(carboxymethyl)-75-(1-hydroxyethyl)-63-(hydroxymethyl)-66-(2-methanesulfinylethyl)-37-methyl-34-(2-methylpropyl)-3,9,12,15,21,24,27,30,33,36,39,42,45,48,54,62,65,68,71,74,77,80,83,90,93-pentacosaoxo-31-(propan-2-yl)-57,58,85,86,95,96-hexathia-2,8,11,14,20,23,26,29,32,35,38,41,44,47,53,61,64,67,70,73,76,79,82,89,92-pentacosaazahexacyclo[58.23.10.425,40.04,8.016,20.049,53]heptanonacontane-88-carboxylic acid
  • L-Phe-L-Phe-L-Cys(1)-L-Pro-L-Phe-Gly-L-Cys(2)-L-Ala-L-Leu-L-Val-L-Asp-L-Cys(2)-Gly-L-Pro-L-Asn-L-Arg-L-Pro-L-Cys(3)-L-Arg-L-Asp-L-Thr-Gly-L-Phe-3-(Methylsulfinylmethyl)-L-Ala-L-Ser-L-Cys(1)-L-Asp-L-Cys(3)-OH