D-Carnitine hydrochloride - 10mM in DMSO , CAS No.10017-44-4

CAS: 10017-44-4 Cat. No.: D420251 Formula: C₇H₁₆ClNO₃ Peso molecolare: 197.66

GRADE & PURITY 10mM in DMSO

Synonyms

(S)-Carnitine hydrochloride | Q27251346 | (S)-Carnitinehydrochloride | 11X758JML9 | Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, chloride, (+)- | D-Carnitine (hydrochloride) | AS-73419 | (+)-(3-Carboxy-2-hydroxypropyl)trimethylammonium chloride | D-Ca

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Panoramica

Information

D-Carnitine hydrochloride ((S)-Carnitine hydrochloride, (+)-Carnitine hydrochloride) is biosynthesized from lysine. It might be associated with the energy production from branched chain amino acids.

Specifications

Sinonimi

(S)-Carnitine hydrochloride | Q27251346 | (S)-Carnitinehydrochloride | 11X758JML9 | Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, chloride, (+)- | D-Carnitine (hydrochloride) | AS-73419 | (+)-(3-Carboxy-2-hydroxypropyl)trimethylammonium chloride | D-Ca

Specifiche e purezza

10mM in DMSO

Meccanismi biochimici e fisiologici

D-Carnitine hydrochloride ((S)-Carnitine hydrochloride, (+)-Carnitine hydrochloride) is biosynthesized from lysine. It might be associated with the energy production from branched chain amino acids.

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Proprietà del prodotto

ALogP

-4.49

hba_count

1

Conteggio HBD

1

Legame rotabile

4

Nomi e identificatori

Pubchem Sid

528764051

Sorrisi canonici

C[N+](C)(C)CC(CC(=O)O)O.[Cl-]

IUPAC Name

[(2S)-3-carboxy-2-hydroxypropyl]-trimethylazanium;chloride

InChIKey

JXXCENBLGFBQJM-RGMNGODLSA-N

INCHI

1S/C7H15NO3.ClH/c1-8(2,3)5-6(9)4-7(10)11;/h6,9H,4-5H2,1-3H3;1H/t6-;/m0./s1

Isomeri SMILES

C[N+](C)(C)C[C@H](CC(=O)O)O.[Cl-]

Peso molecolare

197.66

Reaxy-Rn

4163212

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4163212&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Quaternary ammonium salts

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Quaternary ammonium salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Carnitines
• Alternative Parents: Short-chain hydroxy acids and derivatives Beta hydroxy acids and derivatives Fatty acids and conjugates Tetraalkylammonium salts Secondary alcohols 1,2-aminoalcohols Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic zwitterions Organic oxides Organic chloride salts Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carnitine - Beta-hydroxy acid - Short-chain hydroxy acid - Fatty acid - Hydroxy acid - Tetraalkylammonium salt - 1,2-aminoalcohol - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organooxygen compound - Organic zwitterion - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Amine - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as carnitines. These are organic compounds containing the quaternary ammonium compound carnitine.
• External Descriptors: Not available

Data sources

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

Proprietà chimiche e fisiche

• DMSO (mg/mL) Solubilità massima: 40
• DMSO (mM) Solubilità massima: 202.367702114743
• Acqua (mg/mL) Solubilità massima: 40
• Acqua (mM) Solubilità massima: 202.367702114743
• Peso molecolare: 197.660 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 197.082 Da
• Monoisotopic Mass: 197.082 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 139.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3