Account (2S,4R)-N-((S)-1-((2-(((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)amino)-2-oxoethyl)amino)-5-((diaminomethylene)amino)-1-oxopentan-2-yl)-1-((S)-2-amino-3-(4-fluorophenyl)propanoyl)-4-hydroxypyrrolidine-2-carboxamide bis(2,2,2-trifluoroacetate)
- Catalog No. :
- ACXVUH050
- CAS No. :
- 204992-09-6
- Molecular Formula :
- C37H45F7N10O10
- Molecular Weight :
- 922.81
IUPAC Name:(2S,4R)-N-((S)-1-((2-(((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)amino)-2-oxoethyl)amino)-5-((diaminomethylene)amino)-1-oxopentan-2-yl)-1-((S)-2-amino-3-(4-fluorophenyl)propanoyl)-4-hydroxypyrrolidine-2-carboxamide bis(2,2,2-trifluoroacetate)
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Product Information
| Product Name | (2S,4R)-N-((S)-1-((2-(((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)amino)-2-oxoethyl)amino)-5-((diaminomethylene)amino)-1-oxopentan-2-yl)-1-((S)-2-amino-3-(4-fluorophenyl)propanoyl)-4-hydroxypyrrolidine-2-carboxamide bis(2,2,2-trifluoroacetate) |
|---|---|
| IUPAC Name | (2S,4R)-N-((S)-1-((2-(((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)amino)-2-oxoethyl)amino)-5-((diaminomethylene)amino)-1-oxopentan-2-yl)-1-((S)-2-amino-3-(4-fluorophenyl)propanoyl)-4-hydroxypyrrolidine-2-carboxamide bis(2,2,2-trifluoroacetate) |
| MDL No. | MFCD08690610 |
| Molecular Formula | C37H45F7N10O10 |
| Molecular Weight | 922.81 |
| SMILES | NC(=O)[C@H](CC1=CNC2=CC=CC=C12)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](N)CC1=CC=C(F)C=C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F |
| InChI Key | QXCFOJXOLMOPRK-QOXNQHIRSA-N |
| Synonym | Nemifitide bis(trifluoroacetate) | Nemifitide ditriflutate (USAN) | 4-Fluoro-L-phenylalanyl-trans-4-hydroxy-L-prolyl-L-arginylglycyl-L-tryptophanamide bis(trifluoroacetate) (salt) | HY-105077A | Nemifitide ditriflutate | INN00835 | INN-00835 | 27454M5E8Z |
| CAS No. | 204992-09-6 |
| PubChem CID | 6918347 |
Synthetic Route by SureRoute
2. ACXVUH050 Molecular Building Block Synthetic Route
(S)-2-((S)-1-(L-alanyl-L-threonyl-L-tryptophyl-L-leucyl-L-prolyl)pyrrolidine-2-carboxamido)-5-((diaminomethylene)amino)pentanoic acid
3-((1H-Indol-3-yl)methyl)hexahydropyrrolo[1,2-a]pyrazine-1,4-dione trifluoroacetate
RNAIII-inhibiting peptide(TFA)