Account 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
- Catalog No. :
- ACSZWG514
- CAS No. :
- 332179-76-7
- Molecular Formula :
- C42H60N14O16S4
- Molecular Weight :
- 1145.29
IUPAC Name: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
![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 structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 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 |
|---|---|
| IUPAC Name | 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 |
| Molecular Formula | C42H60N14O16S4 |
| Molecular Weight | 1145.29 |
| SMILES | C[C@H](N)C(=O)N[C@H]1CSSC[C@@H](C(=O)NCC(=O)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CC(=O)O)NC1=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N2 |
| InChI Key | DXIKEERYADAVLF-CFFDDJBSSA-N |
| Synonym | ACDCRGDCFCG (DISULFIDE BRIDGE: 2-10 AND 4-8);H-ALA-CYS-ASP-CYS-ARG-GLY-ASP-CYS-PHE-CYS-GLY-OH (DISULFIDE BRIDGE: 2-10 AND 4-8);ALA-CYS-ASP-CYS-ARG-GLY-ASP-CYS-PHE-CYS-GLY(DISULFIDE BRIDGE:CYS2-CYS10, CYS4-CYS8);RGD-4C;H-Ala-Cys-Asp-Cys-Arg-Gly-Asp-Cys-Phe-Cys-Gly-OH(Cys2-Cys10 , Cys4-Cys8);Glycine, L-alanyl-L-cysteinyl-L-α-aspartyl-L-cysteinyl-L-arginylglycyl-L-α-aspartyl-L-cysteinyl-L-phenylalanyl-L-cysteinyl-, cyclic (2→10),(4→8)-bis(disulfide) |
| CAS No. | 332179-76-7 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACSZWG514 Molecular Building Block Synthetic Route
2-((2S,5R,8R,11S)-5-Benzyl-11-(3-guanidinopropyl)-8-(mercaptomethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)acetic acid
2-((2S,8S,11R,14R)-14-Benzyl-8-(3-guanidinopropyl)-11-(mercaptomethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)acetic acid
2-((2S,5R,8R,11S)-11-(3-Guanidinopropyl)-5-(4-hydroxybenzyl)-8-(mercaptomethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)acetic acid