Account (2S,5S,8S,11S)-2-((S)-sec-Butyl)-5,8-bis(2-carboxyethyl)-4,7,10,13,20-pentaoxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-11-(4-(phosphonooxy)benzyl)-3,6,9,12,19-pentaazatetracosanoic acid
- Catalog No. :
- ACSCTK568
- CAS No. :
- 201422-05-1
- Molecular Formula :
- C41H62N7O16PS
- Molecular Weight :
- 972.02
IUPAC Name:(2S,5S,8S,11S)-2-((S)-sec-Butyl)-5,8-bis(2-carboxyethyl)-4,7,10,13,20-pentaoxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-11-(4-(phosphonooxy)benzyl)-3,6,9,12,19-pentaazatetracosanoic acid
![(2S,5S,8S,11S)-2-((S)-sec-Butyl)-5,8-bis(2-carboxyethyl)-4,7,10,13,20-pentaoxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-11-(4-(phosphonooxy)benzyl)-3,6,9,12,19-pentaazatetracosanoic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2S,5S,8S,11S)-2-((S)-sec-Butyl)-5,8-bis(2-carboxyethyl)-4,7,10,13,20-pentaoxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-11-(4-(phosphonooxy)benzyl)-3,6,9,12,19-pentaazatetracosanoic acid |
|---|---|
| IUPAC Name | (2S,5S,8S,11S)-2-((S)-sec-Butyl)-5,8-bis(2-carboxyethyl)-4,7,10,13,20-pentaoxo-24-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-11-(4-(phosphonooxy)benzyl)-3,6,9,12,19-pentaazatetracosanoic acid |
| Molecular Formula | C41H62N7O16PS |
| Molecular Weight | 972.02 |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC1=CC=C(OP(=O)(O)O)C=C1)NC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)C(=O)O |
| InChI Key | OSDWCPXJLCWMAD-SWZUSDQCSA-N |
| CAS No. | 201422-05-1 |
Synthetic Route by SureRoute
2. ACSCTK568 Molecular Building Block Synthetic Route
Biotinyl-Tyr-Val-Ala-Asp-chloromethylketone
((19S,22S,28S,34S,40S)-19-(3-amino-3-oxopropyl)-49-benzyl-28-((S)-sec-butyl)-34-(carboxymethyl)-52-((S)-2-((S)-2-((S)-5-guanidino-2-((S)-5-guanidino-2-((S)-2-((S)-3-hydroxy-2-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)propanamido)-4-methylpentanamido)pentanamido)pentanamido)-3-hydroxypropanamido)-3-hydroxypropanamido)-31,40-bis(3-guanidinopropyl)-16-(hydroxymethyl)-10-isobutyl-22-methyl-37-(2-(methylthio)ethyl)-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-hexadecaazacyclotripentacontane-4-carbonyl)-L-asparaginyl-L-seryl-L-phenylalanyl-L-arginyl-L-tyrosine
((S)-2-Acetamido-3-(4-(phosphonooxy)phenyl)propanoyl)-L-glutamyl-L-glutamyl-L-isoleucyl-L-glutamic acid