Account ((R)-2-((R)-2-(2-((R)-2-((2R,3R)-2-amino-3-methylpentanamido)-4-methylpentanamido)acetamido)-3-(1H-imidazol-5-yl)propanamido)-5-ureidopentanoyl)-D-aspartyl-D-tyrosyl-D-lysine
- Catalog No. :
- ACLDEN576
- CAS No. :
- 634586-40-6
- Molecular Formula :
- C45H71N13O13
- Molecular Weight :
- 1002.14
IUPAC Name:((R)-2-((R)-2-(2-((R)-2-((2R,3R)-2-amino-3-methylpentanamido)-4-methylpentanamido)acetamido)-3-(1H-imidazol-5-yl)propanamido)-5-ureidopentanoyl)-D-aspartyl-D-tyrosyl-D-lysine
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Product Information
| Product Name | ((R)-2-((R)-2-(2-((R)-2-((2R,3R)-2-amino-3-methylpentanamido)-4-methylpentanamido)acetamido)-3-(1H-imidazol-5-yl)propanamido)-5-ureidopentanoyl)-D-aspartyl-D-tyrosyl-D-lysine |
|---|---|
| IUPAC Name | ((R)-2-((R)-2-(2-((R)-2-((2R,3R)-2-amino-3-methylpentanamido)-4-methylpentanamido)acetamido)-3-(1H-imidazol-5-yl)propanamido)-5-ureidopentanoyl)-D-aspartyl-D-tyrosyl-D-lysine |
| Molecular Formula | C45H71N13O13 |
| Molecular Weight | 1002.14 |
| SMILES | CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](CC1=CN=CN1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](CC1=CC=C(O)C=C1)C(=O)N[C@H](CCCCN)C(=O)O |
| InChI Key | IVQBXMPXSLAIFC-OSMHAOILSA-N |
| Synonym | D-Lysine, D-isoleucyl-D-leucylglycyl-D-histidyl-N5-(aminocarbonyl)-D-ornithyl-D-α-aspartyl-D-tyrosyl-;ILGH-Cit-DYK;PDC31 |
| CAS No. | 634586-40-6 |
Synthetic Route by SureRoute
2. ACLDEN576 Molecular Building Block Synthetic Route
AChRα(97-116)
aspartylalanylglutamylphenylalanylarginylhistidylaspartylserylglycyltyrosylglutamylvalylhistidylhistidylglutaminyllysine
(2S,5S,8S,11S,14S,17S,23S,26S,29S,32S,35S,38S,41S,44S)-5,8,29-tris((1H-imidazol-4-yl)methyl)-44-amino-2-(3-amino-3-oxopropyl)-35-benzyl-14,38-bis(2-carboxyethyl)-26-(carboxymethyl)-32-(3-guanidinopropyl)-17-(4-hydroxybenzyl)-23-(hydroxymethyl)-11-isopropyl-41-methyl-4,7,10,13,16,19,22,25,28,31,34,37,40,43-tetradecaoxo-3,6,9,12,15,18,21,24,27,30,33,36,39,42-tetradecaazahexatetracontanedioic acid