DL-Pipecolinsäure - ≥98% , CAS No.535-75-1

CAS: 535-75-1 Cat. No.: S136371 Summenformel: C₆H₁₁NO₂ Molekulargewicht: 129.16 EG-Nummer: 208-616-3

QUALITÄT & REINHEIT ≥98%

Synonyms

(+/-)-Pipecolinic acid | 2-PIPERIDINECARBOXYLIC ACID | 2-piperidine-carboxylic acid | Acide pipecolique [French] | FT-0613361 | SY003075 | 2-Piperidinecarboxylic acid, (S)- | 2-piperidinic acid | DL-Pipecolic acid;H-DL-Pip-OH | DL-Pipecolinic acid | (D)-(

Storage

Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

(+/-)-Pipecolinic acid | 2-PIPERIDINECARBOXYLIC ACID | 2-piperidine-carboxylic acid | Acide pipecolique [French] | FT-0613361 | SY003075 | 2-Piperidinecarboxylic acid, (S)- | 2-piperidinic acid | DL-Pipecolic acid;H-DL-Pip-OH | DL-Pipecolinic acid | (D)-(

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Aktionsart

INHIBITOR

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488179560

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488179560

Kanonisches Lächeln

C1CCNC(C1)C(=O)O

IUPAC Name

piperidine-2-carboxylic acid

InChIKey

HXEACLLIILLPRG-UHFFFAOYSA-N

INCHI

1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)

Isomere SMILES

C1CCNC(C1)C(=O)O

WGK Deutschland

3

Alternative CAS-Nummer

4043-87-2

Molekulargewicht

129.16

Reaxy-Rn

81095

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=81095&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Amino acids and derivatives
          • Ebene6 Alpha amino acids and derivatives
            • Ebene7 Alpha amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acids
• Alternative Parents: Piperidinecarboxylic acids Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-amino acid - Piperidinecarboxylic acid - Piperidine - Amino acid - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Organic nitrogen compound - Organic oxide - Aliphatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
• External Descriptors: piperidinemonocarboxylic acid

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

Zugehörige Ziele (menschlich)

PTGS2 Tclin Cyclooxygenase-2 (13999 Activities)

Discover Target: PTGS2

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

PIPOX Tbio Peroxisomal sarcosine oxidase (13 Activities)

Discover Target: PIPOX

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

GLI1 Tchem Zinc finger protein GLI1 (201 Activities)

Discover Target: GLI1

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

Zugehörige Ziele (nicht menschlich)

Slc25a20 Carnitine/acylcarnitine translocase (26 Activities)

Discover Target: Slc25a20

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

dapA Dihydrodipicolinate synthase (65 Activities)

Discover Target: dapA

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water (50 mg/ml), and boiling alcohol.
• Schmelzpunkt (°C): 280°C
• Molekulargewicht: 129.160 g/mol
• XLogP3: -2.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 129.079 Da
• Monoisotopic Mass: 129.079 Da
• Topological Polar Surface Area: 49.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 114.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1