H-Pro-Hyp-OH - ≥98% , CAS No.18684-24-7

CAS: 18684-24-7 Cat. No.: H332495 分子式: C₁₀H₁₆N₂O₄ 分子量: 228.25

グレード＆純度 ≥98%

Synonyms

Pro-Hyp | Pro-Hyp-OH | L-Prolyl-L-hydroxyproline | Q27105024 | ONPXCLZMBSJLSP-CSMHCCOUSA-N | (2S,4R)-1-(L-prolyl)-4-hydroxypyrrolidine-2-carboxylic acid | (2S,4R)-4-hydroxy-1-((S)-pyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid | (2S,4R)-4-hydroxy-1-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

仕様

同義語

Pro-Hyp | Pro-Hyp-OH | L-Prolyl-L-hydroxyproline | Q27105024 | ONPXCLZMBSJLSP-CSMHCCOUSA-N | (2S,4R)-1-(L-prolyl)-4-hydroxypyrrolidine-2-carboxylic acid | (2S,4R)-4-hydroxy-1-((S)-pyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid | (2S,4R)-4-hydroxy-1-

仕様と純度

≥98%

保管条件

Store at -20°C

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥98%

名前と識別子

パブケム・シド

504766797

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504766797

カノニカル・スマイル

C1CC(NC1)C(=O)N2CC(CC2C(=O)O)O

IUPAC Name

(2S,4R)-4-hydroxy-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid

InChIKey

ONPXCLZMBSJLSP-CSMHCCOUSA-N

INCHI

1S/C10H16N2O4/c13-6-4-8(10(15)16)12(5-6)9(14)7-2-1-3-11-7/h6-8,11,13H,1-5H2,(H,15,16)/t6-,7+,8+/m1/s1

異性体SMILES

C1C[C@H](NC1)C(=O)N2C[C@@H](C[C@H]2C(=O)O)O

分子量

228.25

Reaxy-Rn

37783883

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=37783883&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Peptides
          • Level6 Dipeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: N-acyl-L-alpha-amino acids Proline and derivatives Alpha amino acid amides Pyrrolidinecarboxamides Pyrrolidine carboxylic acids N-acylpyrrolidines Tertiary carboxylic acid amides Amino acids Secondary alcohols Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-dipeptide - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Proline or derivatives - N-acyl-l-alpha-amino acid - Alpha-amino acid amide - Alpha-amino acid or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Tertiary carboxylic acid amide - Pyrrolidine - Secondary alcohol - Amino acid - Amino acid or derivatives - Carboxamide group - Secondary amine - Azacycle - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Alcohol - Organonitrogen compound - Carbonyl group - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Aliphatic heteromonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
• External Descriptors: dipeptide

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

化学的性質と物理的性質

• 溶解度: Aqueous Acid (Slightly), DMSO (Slightly), Methanol (Slightly)
• 感度: Hygroscopic
• 融点（°C）: 152° C
• 分子量: 228.240 g/mol
• XLogP3: -3.300
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 228.111 Da
• Monoisotopic Mass: 228.111 Da
• Topological Polar Surface Area: 89.900 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 307.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• 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