CAS RN 90984-99-9
CAS RN 90984-99-9
IUPAC Name:
2-(2-{2-[2-(2-{[52-(2-{2-[2-(2-amino-5-carbamimidamidopentanamido)-5-carbamimidamidopentanamido]-3-hydroxypropanamido}-3-hydroxypropanamido)-49-benzyl-28,37-bis(butan-2-yl)-31,40-bis(3-carbamimidamidopropyl)-19-(2-carbamoylethyl)-34-(carboxymethyl)-16-(hydroxymethyl)-22-methyl-10-(2-methylpropyl)-6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51-hexadecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50-hexadecaazacyclotripentacontan-4-yl]formamido}-3-carbamoylpropanamido)-3-hydroxypropanamido]-3-phenylpropanamido}-5-carbamimidamidopentanamido)-3-(4-hydroxyphenyl)propanoic acid
Synonyms:
2-(2-{2-[2-(2-{[52-(2-{2-[2-(2-amino-5-carbamimidamidopentanamido)-5-carbamimidamidopentanamido]-3-hydroxypropanamido}-3-hydroxypropanamido)-49-benzyl-31,40-bis(3-carbamimidamidopropyl)-19-(2-carbamoylethyl)-34-(carboxymethyl)-16-(hydroxymethyl)-22-methyl-10-(2-methylpropyl)-6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51-hexadecaoxo-28,37-bis(sec-butyl)-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50-hexadecaazacyclotripentacontan-4-yl]formamido}-3-carbamoylpropanamido)-3-hydroxypropanamido]-3-phenylpropanamido}-5-carbamimidamidopentanamido)-3-(4-hydroxyphenyl)propanoic acid
Molecular Weight (g/mol):
2862.21
Molecular Formula:
C119H189N43O36S2
InChi Key:
RVAPHXSIIJVIEQ-UHFFFAOYNA-N
SMILES:
CCC(C)C1NC(=O)C(CCCNC(N)=N)NC(=O)C(CC(O)=O)NC(=O)C(NC(=O)C(CCCNC(N)=N)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CSSCC(NC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CO)NC(=O)C(CCC(N)=O)NC(=O)C(C)NC(=O)CNC1=O)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCCNC(N)=N)C(=O)NC(CC1=CC=C(O)C=C1)C(O)=O)NC(=O)C(CO)NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C(N)CCCNC(N)=N)C(C)CC
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