Account Neurokinin A trifluoroacetate
- Catalog No. :
- ACJHHS592
- CAS No. :
- 2828433-19-6
- Molecular Formula :
- C52H81F3N14O16S
- Molecular Weight :
- 1247.36
IUPAC Name:(5S,8S,14S,17S,20S,23S)-23-((2S,3R)-2-((S)-6-amino-2-((S)-2-amino-3-(1H-imidazol-5-yl)propanamido)hexanamido)-3-hydroxybutanamido)-17-benzyl-5-carbamoyl-20-(hydroxymethyl)-8-isobutyl-14-isopropyl-7,10,13,16,19,22-hexaoxo-2-thia-6,9,12,15,18,21-hexaazapentacosan-25-oic acid--2,2,2-trifluoroacetic acid (1/1)
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Product Information
| Product Name | Neurokinin A trifluoroacetate |
|---|---|
| IUPAC Name | (5S,8S,14S,17S,20S,23S)-23-((2S,3R)-2-((S)-6-amino-2-((S)-2-amino-3-(1H-imidazol-5-yl)propanamido)hexanamido)-3-hydroxybutanamido)-17-benzyl-5-carbamoyl-20-(hydroxymethyl)-8-isobutyl-14-isopropyl-7,10,13,16,19,22-hexaoxo-2-thia-6,9,12,15,18,21-hexaazapentacosan-25-oic acid--2,2,2-trifluoroacetic acid (1/1) |
| Molecular Formula | C52H81F3N14O16S |
| Molecular Weight | 1247.36 |
| SMILES | CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC1=CN=CN1)[C@@H](C)O)C(C)C)C(N)=O.O=C(O)C(F)(F)F |
| InChI Key | CPQMHLIZWAQHOV-LEUAYMAXSA-N |
| Synonym | DTXSID701027125 | Neurokinin A (Python molurus) | Substance K | Neurokinin A (alligator) | Neurokinin A (swine spinal cord) | Neuromedin L | 1,2,3-Benzotriazin-4-(3H)one | AKOS040763868 | -Neurokinin;Neuromedin L;Substance K | NS-01628 | AKOS024456420 | 4 |
| CAS No. | 2828433-19-6 |
Synthetic Route by SureRoute
2. ACJHHS592 Molecular Building Block Synthetic Route
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(5S,8S,14S,17S,20S,23S,26S,29S,32S)-26-((1H-imidazol-5-yl)methyl)-32-amino-17,20-dibenzyl-5-carbamoyl-23-(carboxymethyl)-8-isobutyl-14-isopropyl-29-(2-(methylthio)ethyl)-7,10,13,16,19,22,25,28,31-nonaoxo-2-thia-6,9,12,15,18,21,24,27,30-nonaazatetratriacontan-34-oic acid--2,2,2-trifluoroacetic acid (1/2)
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