ficellomycin - Moligand™ , CAS No.59458-27-4

CAS: 59458-27-4 Cat. No.: F610318 PubChem CID: 151592

GRADE & PURITY Moligand™

Synonyms

U-47,929 | DTXSID30974861 | Ficellomycin | Antibiotic U 47929 | CHEBI:156531 | GTPL10965 | [(2-Amino-1-hydroxy-3-methylbutylidene)amino](4-carbamimidamido-1-azabicyclo[3.1.0]hexan-2-yl)acetic acid | 2-[(2-amino-3-methylbutanoyl)amino]-2-[2-(diaminomethyli

Storage

Room temperature

Specifications

동의어

U-47,929 | DTXSID30974861 | Ficellomycin | Antibiotic U 47929 | CHEBI:156531 | GTPL10965 | [(2-Amino-1-hydroxy-3-methylbutylidene)amino](4-carbamimidamido-1-azabicyclo[3.1.0]hexan-2-yl)acetic acid | 2-[(2-amino-3-methylbutanoyl)amino]-2-[2-(diaminomethyli

사양 및 순도

Moligand™

보관 조건

Room temperature

등급

Moligand™

이름과 식별자

• 정식 스마일: OC(=O)C(C1CC(C2N1C2)N=C(N)N)NC(=O)C(C(C)C)N
• IUPAC Name: 2-[(2-amino-3-methylbutanoyl)amino]-2-[4-(diaminomethylideneamino)-1-azabicyclo[3.1.0]hexan-2-yl]acetic acid
• InChIKey: DGIHWRUPUISVIZ-UHFFFAOYSA-N
• INCHI: 1S/C13H24N6O3/c1-5(2)9(14)11(20)18-10(12(21)22)7-3-6(17-13(15)16)8-4-19(7)8/h5-10H,3-4,14H2,1-2H3,(H,18,20)(H,21,22)(H4,15,16,17)
• 이성체 SMILES: CC(C)C(C(=O)NC(C1CC(C2N1C2)N=C(N)N)C(=O)O)N
• PubChem CID: 151592

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 분류: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: Valine and derivatives N-acyl-alpha amino acids Alpha amino acid amides Piperidines N-alkylpyrrolidines N-acyl amines Trialkylamines Secondary carboxylic acid amides Amino acids Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Aziridines Carboximidamides Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Hydrocarbon derivatives Monoalkylamines Organopnictogen compounds
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Valine or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Piperidine - N-alkylpyrrolidine - N-acyl-amine - Fatty acyl - Fatty amide - Pyrrolidine - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Guanidine - Amino acid - Aziridine - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Primary aliphatic amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organopnictogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Primary amine - Aliphatic heteropolycyclic compound
• 설명: 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: 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

화학 및 물리적 특성

• 분자량: 312.370 g/mol
• XLogP3: -4.100
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 312.191 Da
• Monoisotopic Mass: 312.191 Da
• Topological Polar Surface Area: 160.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 490.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 5
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

자주 묻는 질문

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 59458-27-4. InChIKey DGIHWRUPUISVIZ-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.