Account (4S,7S,10S,13S)-10-((1H-imidazol-4-yl)methyl)-7-(2-carboxyethyl)-4-isobutyl-2,5,8,11-tetraoxo-13-((2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl)carbamoyl)-3,6,9,12-tetraazapentadecan-15-oic acid--2,2,2-trifluoroacetic acid (1/1)
- Catalog No. :
- ACDOAL109
- CAS No. :
- 210345-03-2
- Molecular Formula :
- C35H39F6N7O13
- Molecular Weight :
- 879.72
IUPAC Name:(4S,7S,10S,13S)-10-((1H-imidazol-4-yl)methyl)-7-(2-carboxyethyl)-4-isobutyl-2,5,8,11-tetraoxo-13-((2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl)carbamoyl)-3,6,9,12-tetraazapentadecan-15-oic acid--2,2,2-trifluoroacetic acid (1/1)
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Product Information
| Product Name | (4S,7S,10S,13S)-10-((1H-imidazol-4-yl)methyl)-7-(2-carboxyethyl)-4-isobutyl-2,5,8,11-tetraoxo-13-((2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl)carbamoyl)-3,6,9,12-tetraazapentadecan-15-oic acid--2,2,2-trifluoroacetic acid (1/1) |
|---|---|
| IUPAC Name | (4S,7S,10S,13S)-10-((1H-imidazol-4-yl)methyl)-7-(2-carboxyethyl)-4-isobutyl-2,5,8,11-tetraoxo-13-((2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl)carbamoyl)-3,6,9,12-tetraazapentadecan-15-oic acid--2,2,2-trifluoroacetic acid (1/1) |
| Molecular Formula | C35H39F6N7O13 |
| Molecular Weight | 879.72 |
| SMILES | CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CNC=N1)C(=O)N[C@@H](CC(=O)O)C(=O)NC1=CC=C2C(C(F)(F)F)=CC(=O)OC2=C1.O=C(O)C(F)(F)F |
| InChI Key | IKHXNWAISFEPLL-JPIABUGISA-N |
| CAS No. | 210345-03-2 |
Synthetic Route by SureRoute
2. ACDOAL109 Molecular Building Block Synthetic Route
(4S,7S,10S,13S)-10-((1H-Imidazol-5-yl)methyl)-7-(2-carboxyethyl)-4-isobutyl-13-((4-methyl-2-oxo-2H-chromen-7-yl)carbamoyl)-2,5,8,11-tetraoxo-3,6,9,12-tetraazapentadecan-15-oic acid compound with 2,2,2-trifluoroacetic acid (1:1)
(4S,7S,10S,13S)-10-((1H-Imidazol-4-yl)methyl)-4-((1H-indol-3-yl)methyl)-7-(2-carboxyethyl)-2,5,8,11-tetraoxo-13-((2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl)carbamoyl)-3,6,9,12-tetraazapentadecan-15-oic acid
(S)-N-((S)-3-(1H-imidazol-5-yl)-1-((S)-2-((4-methyl-2-oxo-2H-chromen-7-yl)carbamoyl)pyrrolidin-1-yl)-1-oxopropan-2-yl)-5-oxopyrrolidine-2-carboxamide