Account 3-((3S,4S)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile 2-hydroxypropane-1,2,3-tricarboxylate
- Catalog No. :
- ACCLSN438
- CAS No. :
- 2174011-55-1
- Molecular Formula :
- C22H28N6O8
- Molecular Weight :
- 504.5
IUPAC Name:3-((3S,4S)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile 2-hydroxypropane-1,2,3-tricarboxylate
![3-((3S,4S)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile 2-hydroxypropane-1,2,3-tricarboxylate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3-((3S,4S)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile 2-hydroxypropane-1,2,3-tricarboxylate |
|---|---|
| IUPAC Name | 3-((3S,4S)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile 2-hydroxypropane-1,2,3-tricarboxylate |
| Molecular Formula | C22H28N6O8 |
| Molecular Weight | 504.5 |
| SMILES | C[C@H]1CCN(C(=O)CC#N)C[C@H]1N(C)C1=C2C=CNC2=NC=N1.O=C(O)CC(O)(CC(=O)O)C(=O)O |
| InChI Key | SYIKUFDOYJFGBQ-STEACBGWSA-N |
| Synonym | Tofacitib impurity TFB-C;Tofacitinib -S,S-isomer(other isomer);Tofacitinib S,S Isomer;Tofacitinib isomer impurity（TFC3-T1);Tofatinib Impurity C(Citrate);Tofacitinib Impurity 53 Citrate;Tofacitinib Impurity 62 Citrate;Tofacitinib Impurity 58 Citrate |
| CAS No. | 2174011-55-1 |
Synthetic Route by SureRoute
2. ACCLSN438 Molecular Building Block Synthetic Route
3-((3R,4R)-4-Methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile 2-hydroxypropane-1,2,3-tricarboxylate
3-((3R,4R)-4-Methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile
3-((3R,4S)-4-Methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile