Account Maraciclatide
- Catalog No. :
- ACUMZV674
- CAS No. :
- 489427-17-0
- Molecular Formula :
- C72H120N20O21S3
- Molecular Weight :
- 1698.07
IUPAC Name:2-((1R,4S,10R,13S,16R,19S,25S)-10-((1-amino-1,5-dioxo-3,9,12,15-tetraoxa-6-azaheptadecan-17-yl)carbamoyl)-13-benzyl-25-(3-guanidinopropyl)-4-(4-(5-((5-(((E)-3-(hydroxyimino)-2-methylbutan-2-yl)amino)-3-(2-(((E)-3-(hydroxyimino)-2-methylbutan-2-yl)amino)ethyl)pentyl)amino)-5-oxopentanamido)butyl)-3,6,12,15,18,21,24,27-octaoxo-8,29,30-trithia-2,5,11,14,17,20,23,26-octaazabicyclo[14.11.4]hentriacontan-19-yl)acetic acid
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Product Information
| Product Name | Maraciclatide |
|---|---|
| IUPAC Name | 2-((1R,4S,10R,13S,16R,19S,25S)-10-((1-amino-1,5-dioxo-3,9,12,15-tetraoxa-6-azaheptadecan-17-yl)carbamoyl)-13-benzyl-25-(3-guanidinopropyl)-4-(4-(5-((5-(((E)-3-(hydroxyimino)-2-methylbutan-2-yl)amino)-3-(2-(((E)-3-(hydroxyimino)-2-methylbutan-2-yl)amino)ethyl)pentyl)amino)-5-oxopentanamido)butyl)-3,6,12,15,18,21,24,27-octaoxo-8,29,30-trithia-2,5,11,14,17,20,23,26-octaazabicyclo[14.11.4]hentriacontan-19-yl)acetic acid |
| Molecular Formula | C72H120N20O21S3 |
| Molecular Weight | 1698.07 |
| SMILES | C/C(=N\O)C(C)(C)NCCC(CCNC(=O)CCCC(=O)NCCCC[C@@H]1NC(=O)CSC[C@@H](C(=O)NCCOCCOCCOCCNC(=O)COCC(N)=O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N2)CCNC(C)(C)/C(C)=N/O |
| InChI Key | OTOMOKKNHNZSBB-ZHQNANIESA-N |
| Synonym | L-Cysteinamide, N6-[5-[[5-[[2-(hydroxyimino)-1,1-dimethylpropyl]amino]-3-[2-[[2-(hydroxyimino)-1,1-dimethylpropyl]amino]ethyl]pentyl]amino]-1,5-dioxopentyl]-N2-(2-mercaptoacetyl)-L-lysyl-L-cysteinyl-L-arginylglycyl-L-α-aspartyl-L-cysteinyl-L-phenylalanyl-N-(17-amino-13,17-dioxo-3,6,9,15-tetraoxa-12-azaheptadec-1-yl)-, cyclic (1→8)-thioether, cyclic (2→6)-disulfide;L-Cysteinamide, N6-[5-[[5-[[2-(hydroxyimino)-1,1-dimethylpropyl]amino]-3-[2-[[2-(hydroxyimino)-1,1-dimethylpropyl]amino]ethyl]pentyl]amino]-1,5-dioxopentyl]-N2-(2-mercaptoacetyl)-L-lysyl-L-cysteinyl-L-arginylglycyl-L-α-aspartyl-L-cysteinyl-L-phenylalanyl-N-(17-amino-13,17-dioxo-3,6,9,15-tetraoxa-12-... |
| CAS No. | 489427-17-0 |
Synthetic Route by SureRoute
2. ACUMZV674 Molecular Building Block Synthetic Route
2,2'-((1R,4S,7R,12R,15S,18R,21S,27S)-7-((S)-2-Aminopropanamido)-15-benzyl-12-((carboxymethyl)carbamoyl)-27-(3-guanidinopropyl)-3,6,14,17,20,23,26,29-octaoxo-9,10,31,32-tetrathia-2,5,13,16,19,22,25,28-octaazabicyclo[16.11.4]tritriacontane-4,21-diyl)diacetic acid
(4R,10S,16S,19S,22S,28S,31S,34S,37S,40S,43S,49S,52R)-52-((5S,8S,11S)-14-amino-5-(4-aminobutyl)-8-(hydroxymethyl)-11-isobutyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazatetradecanamido)-40-(4-aminobutyl)-49-benzyl-28-((S)-sec-butyl)-34-(carboxymethyl)-31-(3-guanidinopropyl)-16,22-bis(hydroxymethyl)-10,37,43-triisobutyl-19-(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-carboxylic acid
Sunflower trypsin inhibitor 1