Account (2S)-N-((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((5-aminopentanoyl)-L-phenylalanylphenylalanyl)-N-methylpyrrolidine-2-carboxamide
- Catalog No. :
- ACUJZA886
- CAS No. :
- 133156-06-6
- Molecular Formula :
- C40H59N7O6S
- Molecular Weight :
- 766.02
IUPAC Name:(2S)-N-((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((5-aminopentanoyl)-L-phenylalanylphenylalanyl)-N-methylpyrrolidine-2-carboxamide
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Product Information
| Product Name | (2S)-N-((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((5-aminopentanoyl)-L-phenylalanylphenylalanyl)-N-methylpyrrolidine-2-carboxamide |
|---|---|
| IUPAC Name | (2S)-N-((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((5-aminopentanoyl)-L-phenylalanylphenylalanyl)-N-methylpyrrolidine-2-carboxamide |
| Molecular Formula | C40H59N7O6S |
| Molecular Weight | 766.02 |
| SMILES | [H][C@@](NC([C@](CC(C)C)(N(C([C@@]1(CCCN1C(C(CC2=CC=CC=C2)(NC([C@](CC3=CC=CC=C3)(NC(CCCCN)=O)[H])=O)[H])=O)[H])=O)C)[H])=O)(C(N)=O)CCSC |
| InChI Key | HQKPTSSZOJLFBZ-SUTSVXMESA-N |
| Synonym | δ-Aminovaleryl-[Pro9, Leu(N-Me)10]-SubstanceP Fragment 7-11;N-(5-Amino-1-oxopentyl)-L-Phe-L-Phe-L-Pro-N-methyl-L-Leu-L-Met-NH2;(2S)-1-[(2S)-2-[[(2S)-2-(5-aminopentanoylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]-N-[(1S)-1-[[(1S)-1-carbamoyl-3-(methylthio)propyl]carbamoyl]-3-methyl-butyl]-N-methyl-pyrrolidine-2-carboxamide;(2S)-N-[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-1-[(2S)-2-[[(2S)-2-(5-aminopentanoylamino)-3-phenylpropanoyl]amino]-3-phenylpropanoyl]-N-methylpyrrolidine-2-carboxamide;(2S)-N-[(2S)-1-[[(2S)-1-azanyl-4-methylsulfanyl-1-oxo-butan-2-yl]amino]-4-methyl-1-oxo-pentan-2-yl]-1-[(2S)-2-[[(2S)-2-(5-azanylpentanoylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]-N-methyl-pyrrolidine-2-carboxamide;d-AMinovaleryl-(Pro9,N-Me-Leu10)-Substance P (7-11);d-AMinovaleryl-Phe-Phe-Pro-N-Me-Leu-Met-NH2;GR 73632 |
| CAS No. | 133156-06-6 |
Synthetic Route by SureRoute
2. ACUJZA886 Molecular Building Block Synthetic Route
(2S)-N-((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((5-aminopentanoyl)-L-phenylalanylphenylalanyl)-N-methylpyrrolidine-2-carboxamide hydrochloride
(2S)-N-((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((5-aminopentanoyl)-L-phenylalanylphenylalanyl)-N-methylpyrrolidine-2-carboxamide hemiacetate
(2S)-N-((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-1-((5-aminopentanoyl)-L-phenylalanylphenylalanyl)-N-methylpyrrolidine-2-carboxamide 2,2,2-trifluoroacetate