4-Hydroxy-L-(+)-2-phenylglycine - Moligand™,≥99% , CAS No.32462-30-9

CAS: 32462-30-9 Cat. No.: H157171 Peso molecular: 167.16 Beilstein Registry Number: 3589850 Número EC: 251-061-7

GRADE & PURITY Moligand™, ≥99%

Synonyms

AC-24628 | DS-11081 | p-Hydroxy-L-phenylglycine | (S)-2-AMINO-2-(4-HYDROXYPHENYL)ACETIC ACID | (S)-Amino-(4-hydroxyphenyl)acetic acid | 4-Hydroxy-L-phenylglycine | CAS-32462-30-9 | H-Phg(4-OH)-OH | Oxfenicina | BDBM50403035 | H1389 | SCHEMBL122315 | UNII-

Storage

Room temperature

Shipped In

Normal

Descripción general

L-p-Hydroxyphenylglycine is an carnitine palmitoyltransferase-1 inhibitor. L-p-Hydroxyphenylglycine inhibits the oxidation of fatty acids in the heart, protecting cardiac tissue from necrotic damage during ischemia, and also has an inhibitory effect on cardiac tissue apoptosis. In addition, L-p-Hydroxyphenylglycine promotes lipolysis in a high-fat diet rat model. L-p-Hydroxyphenylglycine can be used in the study of cardiovascular and metabolic diseases.

Specifications

Sinónimos

AC-24628 | DS-11081 | p-Hydroxy-L-phenylglycine | (S)-2-AMINO-2-(4-HYDROXYPHENYL)ACETIC ACID | (S)-Amino-(4-hydroxyphenyl)acetic acid | 4-Hydroxy-L-phenylglycine | CAS-32462-30-9 | H-Phg(4-OH)-OH | Oxfenicina | BDBM50403035 | H1389 | SCHEMBL122315 | UNII-

Especificaciones y pureza

Moligand™, ≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Grado

Moligand™

Tipo de acción

INHIBITOR

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 488183269
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183269
• Sonrisas canónicas: C1=CC(=CC=C1C(C(=O)O)N)O
• IUPAC Name: (2S)-2-amino-2-(4-hydroxyphenyl)acetic acid
• InChIKey: LJCWONGJFPCTTL-ZETCQYMHSA-N
• INCHI: 1S/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m0/s1
• Isómeros SMILES: C1=CC(=CC=C1[C@@H](C(=O)O)N)O
• WGK Alemania: 3
• Peso molecular: 167.16
• Beilstein: 3589850
• Reaxy-Rn: 513130
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=513130&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alpha amino acids
              • Level8 L-alpha-amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives - Alpha amino acids
• Direct Parent: L-alpha-amino acids
• Alternative Parents: Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: L-alpha-amino acid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Hydrocarbon derivative - Primary amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Primary aliphatic amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom.
• External Descriptors: 4-hydroxyphenylglycine

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

Objetivos asociados (humanos)

CPT2 Tchem Carnitine palmitoyltransferase 2 (510 Activities)

Discover Target: CPT2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC1A4 Tbio Neutral amino acid transporter A (18 Activities)

Discover Target: SLC1A4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

KB (17409 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CPT1A Tchem Carnitine O-palmitoyltransferase 1, liver isoform (507 Activities)

Discover Target: CPT1A

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CPT1B Tchem Carnitine O-palmitoyltransferase 1, muscle isoform (497 Activities)

Discover Target: CPT1B

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC1A5 Tchem Neutral amino acid transporter B(0) (65 Activities)

Discover Target: SLC1A5

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Objetivos asociados (no humanos)

Galc Galactocerebrosidase (11 Activities)

Discover Target: Galc

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Rattus norvegicus (775804 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Grin1 Glutamate NMDA receptor (6467 Activities)

Discover Target: Grin1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Slc1a5 Amino acid transporter (271 Activities)

Discover Target: Slc1a5

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Slc7a10 Asc-type amino acid transporter 1 (14 Activities)

Discover Target: Slc7a10

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Rotación específica [α]: 155° (C=1,1mol/L HCl)
• Punto de fusión (°C): 214°C(dec.)(lit.)
• Peso molecular: 167.160 g/mol
• XLogP3: -2.100
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 167.058 Da
• Monoisotopic Mass: 167.058 Da
• Topological Polar Surface Area: 83.600 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 164.000
• 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: 1