Fluorescein biotin [5-((N-(5-(N-(6-(biotinoyl)amino)hexanoyl)amino)pentyl)thioureidyl)fluorescein] - ≥90% , CAS No.134759-22-1

CAS: 134759-22-1 Cat. No.: F131095 Molecular Weight: 831.012 PubChem CID: 90469808

GRADE & PURITY ≥90%

Synonyms

1H-Thieno[3,4-d]imidazole-4-pentanamide, N-[6-[[5-[[[(3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)amino]thioxomethyl]amino]pentyl]amino]-6-oxohexyl]hexahydro-2-oxo-, (3aS,4S,6aR)- (9CI)

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Fluorescein Biotin is used as an alternative to radioactive biotin for detecting and quantitating biotin-binding sites by either fluorescence or absorbance; the the fluorescence or absorbance of Fluorescein Biotin is quenched, upon binding to avidin or streptavidin.

Specifications

Synonyms

1H-Thieno[3, 4-d]imidazole-4-pentanamide, N-[6-[[5-[[[(3', 6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H), 9'-[9H]xanthen]-5-yl)amino]thioxomethyl]amino]pentyl]amino]-6-oxohexyl]hexahydro-2-oxo-, (3aS, 4S, 6aR)- (9CI)

Specifications & Purity

≥90%

Storage

Protected from light, Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥90%

Names and Identifiers

• Pubchem Sid: 504772583
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504772583
• Canonical Smiles: C1C2C(C(S1)CCCCC(=O)NCCCCCC(=O)NCCCCCNC(=S)NC3=CC4=C(C=C3)C5(C6=C(C=C(C=C6)O)OC7=C5C=CC(=C7)O)OC4=O)NC(=O)N2
• IUPAC Name: 6-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-N-[5-[(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)carbamothioylamino]pentyl]hexanamide
• InChIKey: MFVSXUVAYGNGJQ-INIOENKZSA-N
• INCHI: 1S/C42H50N6O8S2/c49-26-13-16-30-33(22-26)55-34-23-27(50)14-17-31(34)42(30)29-15-12-25(21-28(29)39(53)56-42)46-41(57)45-20-8-2-7-19-44-36(51)10-3-1-6-18-43-37(52)11-5-4-9-35-38-32(24-58-35)47-40(54)48-38/h12-17,21-23,32,35,38,49-50H,1-11,18-20,24H2,(H,43,52)(H,44,51)(H2,45,46,57)(H2,47,48,54)/t32-,35-,38-/m0/s1
• Isomeric SMILES: C1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)NCCCCCC(=O)NCCCCCNC(=S)NC3=CC4=C(C=C3)C5(C6=C(C=C(C=C6)O)OC7=C5C=CC(=C7)O)OC4=O)NC(=O)N2
• PubChem CID: 90469808
• Molecular Weight: 831.012

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Biotin and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Biotin and derivatives
• Alternative Parents: Xanthenes Diarylethers Benzofuranones Phthalides Isobenzofurans Thienoimidazolidines 1-hydroxy-2-unsubstituted benzenoids Imidazolidinones N-acyl amines Thiophenes Thiolanes Ureas Thioureas Carboxylic acid esters Secondary carboxylic acid amides Lactones Dialkylthioethers Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Biotin_derivative - Xanthene - Dibenzopyran - Diaryl ether - Benzofuranone - Phthalide - Benzopyran - Isobenzofuranone - 1-benzopyran - Isocoumaran - Isobenzofuran - Thienoimidazolidine - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Fatty acyl - Imidazolidinone - Benzenoid - Fatty amide - N-acyl-amine - Imidazolidine - Thiolane - Thiophene - Lactone - Secondary carboxylic acid amide - Carboxylic acid ester - Thiourea - Urea - Carboxamide group - Carboxylic acid derivative - Oxacycle - Azacycle - Dialkylthioether - Ether - Thioether - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: 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

Chemical and Physical Properties

• Sensitivity: light sensitive
• Molecular Weight: 831.000 g/mol
• XLogP3: 4.300
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 18
• Exact Mass: 830.313 Da
• Monoisotopic Mass: 830.313 Da
• Topological Polar Surface Area: 257.000 Ų
• Heavy Atom Count: 58
• Formal Charge: 0
• Complexity: 1430.000
• 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