AP 811 - モリガンド™, ≥98 , Antagonist of natriuretic peptide receptor 3, CAS No.124833-45-0, Antagonist of natriuretic peptide receptor 3

CAS: 124833-45-0 Cat. No.: A288690 分子式: C₄₆H₆₆N₁₂O₈ 分子量: 915.11 PubChem CID: 44301714

GRADE & PURITY Moligand™, ≥98%

Storage

20℃で保存

Shipped In

アイスチェスト＋アイスパッド

概要

AP811は選択的な心房性ナトリウム利尿ペプチドクリアランス受容体（ANP-CR、NPR3）拮抗薬で、Kiは0.48 nMである。AP811はNPR1よりもNPR3に対して2,000倍以上の選択性を示す。AP811はANPによるポンプ刺激を消失させる。

Specifications

仕様と純度

モリガンド™, ≥98

生化学的・生理学的メカニズム

高親和性、選択的ANPクリアランス受容体（NPR3）アンタゴニスト（Ki= 0.45 nM）。NPR1に対して20,000倍以上のNPR3選択性を示す。試験管内のウサギ心室心筋細胞において、ANP刺激によるNa+/K+ポンプ活性を阻害する。またr

保管条件

20℃で保存

入荷

アイスチェスト＋アイスパッド

等級

Moligand™

アクションタイプ

ANTAGONIST

作用メカニズム

Antagonist of natriuretic peptide receptor 3

純度

≥98%

名前と識別子

• カノニカル・スマイル: CCC(C)CNC(=O)C(CCCN=C(N)N)NC(=O)C(CC(=O)O)NC(=O)C(C(C)CC)NC(=O)C(CCCN=C(N)N)NC(=O)CC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2
• IUPAC Name: (3S)-4-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-2-methylbutyl]amino]-1-oxopentan-2-yl]amino]-3-[[(2S,3S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-[4-(naphthalene-2-carbonylamino)phenyl]acetyl]amino]pentanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoic acid
• InChIKey: UNMJSSQZDQBGDS-OCFLPWLCSA-N
• INCHI: 1S/C46H66N12O8/c1-5-27(3)26-53-41(63)34(13-9-21-51-45(47)48)56-43(65)36(25-38(60)61)57-44(66)39(28(4)6-2)58-42(64)35(14-10-22-52-46(49)50)55-37(59)23-29-15-19-33(20-16-29)54-40(62)32-18-17-30-11-7-8-12-31(30)24-32/h7-8,11-12,15-20,24,27-28,34-36,39H,5-6,9-10,13-14,21-23,25-26H2,1-4H3,(H,53,63)(H,54,62)(H,55,59)(H,56,65)(H,57,66)(H,58,64)(H,60,61)(H4,47,48,51)(H4,49,50,52)/t27-,28-,34-,35-,36-,39-/m0/s1
• 異性体SMILES: CC[C@H](C)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2
• PubChem CID: 44301714
• 分子量: 915.11

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 Oligopeptides

• 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: Oligopeptides
• Alternative Parents: Naphthalene-2-carboxanilides Aromatic anilides Aspartic acid and derivatives Isoleucine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylacetamides N-acyl amines Secondary carboxylic acid amides Guanidines Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Alpha-oligopeptide - Naphthalene-2-carboxanilide - Aspartic acid or derivatives - Aromatic anilide - Isoleucine or derivatives - N-acyl-alpha amino acid or derivatives - 2-naphthalenecarboxamide - 2-naphthalenecarboxylic acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Naphthalene - Phenylacetamide - Monocyclic benzene moiety - Fatty acyl - N-acyl-amine - Fatty amide - Benzenoid - Guanidine - Carboxamide group - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboximidamide - Organic 1,3-dipolar compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homopolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds.
• 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

関連ターゲット（人間）

NPR3 Tchem Atrial natriuretic peptide receptor 3 (1 Activities)

Discover Target: NPR3

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

NPR1 Tclin Atrial natriuretic peptide receptor A (169 Activities)

Discover Target: NPR1

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

関連ターゲット（非人間）

Npr3 Atrial natriuretic peptide receptor C (17 Activities)

Discover Target: Npr3

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

作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble to 1 (mg/mL) in water
• 感度: Moisture sensitive