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Serdexmethylphenidate chloride , Dopamine transporter inhibitor, CAS No.1996626-30-2, Dopamine transporter inhibitor

COA

Cas Number: 1996626-30-2
Molecular Weight: 536
PubChem CID: 134823897

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Item Number

S671342

Grouped product items
SKU	Size	Availability	Price	Qty
S671342-1mg	1mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$999.90

Basic Description

Synonyms	Serdexmethylphenidate chloride \| SERDEXMETHYLPHENIDATE CHLORIDE [ORANGE BOOK] \| Pyridinium, 3-((((1S)-1-carboxy-2-hydroxyethyl)amino)carbonyl)-1-(((((2R)-2-((1R)-2-methoxy-2-oxo-1-phenylethyl)-1-piperidinyl)carbonyl)oxy)methyl)-, chloride (1:1) \| Serdexme
Action Type	INHIBITOR
Mechanism of action	Dopamine transporter inhibitor

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Amino acids, peptides, and analogues
      - Level5 Amino acids and derivatives
        Level6 Alpha amino acids and derivatives
        Level7 N-acyl-alpha amino acids and derivatives
        Level8 N-acyl-alpha amino acids

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Intermediate Tree Nodes	Amino acids and derivatives - Alpha amino acids and derivatives - N-acyl-alpha amino acids and derivatives
Direct Parent	N-acyl-alpha amino acids
Alternative Parents	Serine and derivatives Piperidinecarboxylic acids Nicotinamides Methylpyridines Hydroxypyridines Fatty acid esters Beta hydroxy acids and derivatives N-acyl amines Dicarboxylic acids and derivatives Benzene and substituted derivatives Vinylogous amides Methyl esters Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Carboxylic acids Carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic zwitterions Organic oxides Organic chloride salts Hydrocarbon derivatives Alcohols and polyols
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	N-acyl-alpha-amino acid - Serine or derivatives - Pyridine carboxylic acid or derivatives - Piperidinecarboxylic acid - Nicotinamide - Methylpyridine - Hydroxypyridine - Fatty acid ester - Beta-hydroxy acid - Fatty acyl - Benzenoid - Pyridine - Piperidine - N-acyl-amine - Hydroxy acid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Methyl ester - Carbamic acid ester - Carbonic acid derivative - Carboxylic acid ester - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	(2S)-3-hydroxy-2-[[1-[[(2R)-2-[(1R)-2-methoxy-2-oxo-1-phenylethyl]piperidine-1-carbonyl]oxymethyl]pyridin-1-ium-3-carbonyl]amino]propanoic acid;chloride
INCHI	InChI=1S/C25H29N3O8.ClH/c1-35-24(33)21(17-8-3-2-4-9-17)20-11-5-6-13-28(20)25(34)36-16-27-12-7-10-18(14-27)22(30)26-19(15-29)23(31)32;/h2-4,7-10,12,14,19-21,29H,5-6,11,13,15-16H2,1H3,(H-,26,30,31,32);1H/t19-,20+,21+;/m0./s1
InChIKey	GONQEUJYYMYNMN-HWAJWLCKSA-N
Smiles	COC(=O)C(C1CCCCN1C(=O)OC[N+]2=CC=CC(=C2)C(=O)NC(CO)C(=O)O)C3=CC=CC=C3.[Cl-]
Isomeric SMILES	COC(=O)[C@@H]([C@H]1CCCCN1C(=O)OC[N+]2=CC=CC(=C2)C(=O)N[C@@H](CO)C(=O)O)C3=CC=CC=C3.[Cl-]
Molecular Weight	536
Reaxy-Rn	33161481
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=33161481&ln=

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