Account U 70714E
- Catalog No. :
- ACXJZB646
- CAS No. :
- 114376-16-8
- Molecular Formula :
- C66H76N12O10
- Molecular Weight :
- 1197.41
IUPAC Name:(S)-1-(Na-acetyl-1-formyl-L-tryptophyl)-N-((S)-1-(((S)-1-(((S)-1-(((S)-1-(((S)-1-(((S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)amino)-1-oxo-3-phenylpropan-2-yl)amino)-3-phenylpropan-2-yl)amino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl)amino)-1-oxo-3-phenylpropan-2-yl)pyrrolidine-2-carboxamide
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Product Information
| Product Name | U 70714E |
|---|---|
| IUPAC Name | (S)-1-(Na-acetyl-1-formyl-L-tryptophyl)-N-((S)-1-(((S)-1-(((S)-1-(((S)-1-(((S)-1-(((S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)amino)-1-oxo-3-phenylpropan-2-yl)amino)-3-phenylpropan-2-yl)amino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl)amino)-1-oxo-3-phenylpropan-2-yl)pyrrolidine-2-carboxamide |
| Molecular Formula | C66H76N12O10 |
| Molecular Weight | 1197.41 |
| SMILES | O=C([C@H]1N(C([C@H](CC2=CN(C=O)C3=C2C=CC=C3)NC(C)=O)=O)CCC1)N[C@@H](CC4=CC=CC=C4)C(N[C@@H](CC5=CNC=N5)C(N[C@@H](CC6=CC=CC=C6)CN[C@@H](CC7=CC=CC=C7)C(N[C@@H](C(C)C)C(N[C@@H](CC8=CC=C(O)C=C8)C(N)=O)=O)=O)=O)=O |
| InChI Key | FFSCESWJZKPQHE-XVLSDOAMSA-N |
| Synonym | U 70714E;Ac-Ftr-Pro-Phe-His-PheΦPhe-Val-Tyr-NH2;L-Tyrosinamide, N-[2-[[N-[N-[1-(N-acetyl-1-formyl-L-tryptophyl)-L-prolyl]-L-phenylalanyl]-L-histidyl]amino]-3-phenylpropyl]-L-phenylalanyl-L-valyl-, (S)- (9CI) |
| CAS No. | 114376-16-8 |
Synthetic Route by SureRoute
2. ACXJZB646 Molecular Building Block Synthetic Route
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(S)-N-(2-amino-2-oxoethyl)-1-(((S)-5-oxopyrrolidine-2-carbonyl)-L-histidyl-L-tryptophyl-L-seryl-L-tyrosylglycyl-L-tryptophyl-L-leucyl)pyrrolidine-2-carboxamide
(2S)-N1-((2S)-1-(((2S)-1-((1-((2-(((S)-1-(((S)-1-(((S)-1-amino-4-(methylthio)-1-oxobutan-2-yl)amino)-1-oxo-3-phenylpropan-2-yl)amino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl)amino)-2-oxoethyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-1-oxopropan-2-yl)amino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl)-2-((2S)-1-((5-oxopyrrolidine-2-carbonyl)valyl)pyrrolidine-2-carboxamido)pentanediamide