Account MC-Val-Cit-PAB-Amide-TLR7 agonist 4
- Catalog No. :
- ACMZDX882
- CAS No. :
- 2413016-49-4
- Molecular Formula :
- C52H72N12O11
- Molecular Weight :
- 1041.22
IUPAC Name:4-((S)-2-((S)-2-(6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido)-3-methylbutanamido)-5-ureidopentanamido)benzyl (1-((2-((1-(4-amino-2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-yl)oxy)ethyl)amino)-2-methyl-1-oxopropan-2-yl)carbamate
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Product Information
| Product Name | MC-Val-Cit-PAB-Amide-TLR7 agonist 4 |
|---|---|
| IUPAC Name | 4-((S)-2-((S)-2-(6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido)-3-methylbutanamido)-5-ureidopentanamido)benzyl (1-((2-((1-(4-amino-2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-yl)oxy)ethyl)amino)-2-methyl-1-oxopropan-2-yl)carbamate |
| Molecular Formula | C52H72N12O11 |
| Molecular Weight | 1041.22 |
| SMILES | O=C(OCC1=CC=C(NC([C@@H](NC([C@@H](NC(CCCCCN2C(C=CC2=O)=O)=O)C(C)C)=O)CCCNC(N)=O)=O)C=C1)NC(C)(C)C(NCCOC(C)(C)CN3C(COCC)=NC4=C3C5=CC=CC=C5N=C4N)=O |
| InChI Key | ABHUQCRIABWZHT-VPHSWYRMSA-N |
| Synonym | MC-Val-Cit-PAB-Amide-TLR7 agonist 4;MC-Val-Cit-PAB-Amide-TLR7 agonist 4 Conjugate |
| CAS No. | 2413016-49-4 |
Synthetic Route by SureRoute
2. ACMZDX882 Molecular Building Block Synthetic Route
TLR8 agonist 5
2-Amino-N-(2-((1-(4-amino-2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-yl)oxy)ethyl)-2-methylpropanamide
4-((S)-2-((S)-2-(6-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido)-3-methylbutanamido)-5-ureidopentanamido)benzyl ((1S,9S)-9-ethyl-5-fluoro-9-hydroxy-4-methyl-10,13-dioxo-2,3,9,10,13,15-hexahydro-1H,12H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinolin-1-yl)carbamate