GRADE & PURITY ≥95%

Synonyms

Photobiotin acetate salt | 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[3-[3-(4-azido-2-nitroanilino)propyl-methylamino]propyl]pentanamide;acetic acid | HY-W127719 | Biotin {3-[3-(4-azido-2-nitroanilino)-N-methylpropylamino]

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Product Description
Photobiotin acetate is made up of biotin, which is bound with the help of a charged linker arm to a photoreactive arylazide group. Product Application
Photobiotin acetate salt has been used to label DNA probes to perform DNA−DNA hybridization to determine genomic relatedness.

Specifications

Sinónimos

Photobiotin acetate salt | 5-[(3aS, 4S, 6aR)-2-oxo-1, 3, 3a, 4, 6, 6a-hexahydrothieno[3, 4-d]imidazol-4-yl]-N-[3-[3-(4-azido-2-nitroanilino)propyl-methylamino]propyl]pentanamide;acetic acid | HY-W127719 | Biotin {3-[3-(4-azido-2-nitroanilino)-N-methylpropylamino]

Especificaciones y pureza

≥95%

Mecanismos bioquímicos y fisiológicos

Photobiotin is a photo-activatable analog of biotin used primarily for labeling DNA, RNA and proteins. Probes prepared using photobiotin can detect target DNA as little as 0.5 pg. Photobiotin acetate is capable of labeling single stranded DNA and linear o

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CC(=O)O.CN(CCCNC1=C(C=C(C=C1)N=[N+]=[N-])[N+](=O)[O-])CCCNC(=O)CCCCC2C3C(CS2)NC(=O)N3
• IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[3-[3-(4-azido-2-nitroanilino)propyl-methylamino]propyl]pentanamide;acetic acid
• InChIKey: FFBLNTOMOSLSQM-AYEYRVMASA-N
• INCHI: 1S/C23H35N9O4S.C2H4O2/c1-31(12-4-10-25-17-9-8-16(29-30-24)14-19(17)32(35)36)13-5-11-26-21(33)7-3-2-6-20-22-18(15-37-20)27-23(34)28-22;1-2(3)4/h8-9,14,18,20,22,25H,2-7,10-13,15H2,1H3,(H,26,33)(H2,27,28,34);1H3,(H,3,4)/t18-,20-,22-;/m0./s1
• Isómeros SMILES: CC(=O)O.CN(CCCNC1=C(C=C(C=C1)N=[N+]=[N-])[N+](=O)[O-])CCCNC(=O)CCCC[C@H]2[C@@H]3[C@H](CS2)NC(=O)N3
• PubChem CID: 16218863
• Peso molecular: 593.7

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Biotin and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Biotin and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Biotin and derivatives
• Alternative Parents: Nitrobenzenes Nitroaromatic compounds Aniline and substituted anilines Phenylalkylamines Phenylazides Thienoimidazolidines Secondary alkylarylamines Imidazolidinones N-acyl amines Thiolanes Thiophenes Amino acids and derivatives Ureas Azo compounds Secondary carboxylic acid amides Azo imides Trialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Organic zwitterions Organopnictogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Biotin_derivative - Nitrobenzene - Thienoimidazolidine - Nitroaromatic compound - Phenylazide - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Imidazolidinone - Fatty acyl - Fatty amide - Monocyclic benzene moiety - Benzenoid - N-acyl-amine - Imidazolidine - Thiophene - Thiolane - Amino acid or derivatives - Azo compound - Azo imide - Carboxamide group - C-nitro compound - Organic nitro compound - Carbonic acid derivative - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Urea - Carboxylic acid - Carboxylic acid derivative - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Thioether - Propargyl-type 1,3-dipolar organic compound - Azacycle - Monocarboxylic acid or derivatives - Secondary amine - Organic 1,3-dipolar compound - Dialkylthioether - Organooxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Amine - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as biotin and derivatives. These are organic compounds containing a ureido (tetrahydroimidizalone) ring fused with a tetrahydrothiophene ring.
• 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

Propiedades químicas y físicas

• Peso molecular: 593.700 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 15
• Exact Mass: 593.274 Da
• Monoisotopic Mass: 593.274 Da
• Topological Polar Surface Area: 208.000 Ų
• Heavy Atom Count: 41
• Formal Charge: 0
• Complexity: 854.000
• 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: 2

XLogP3