(+)-Biotin N-hydroxysuccinimide ester (CED0005042)

Record Information
Version1.0
Creation Date2026-04-03 00:32:51 UTC
Update Date2026-08-19 06:39:17 UTC
Accession NumberCHEM059339
Identification
Common Name(+)-Biotin N-hydroxysuccinimide ester
ClassSmall Molecule
Description
(+)-Biotin N-hydroxysuccinimide ester belongs to the biotin and derivatives, a class of organoheterocyclic compounds within the organic compounds. This compound has the formula C14H19N3O5S1 and an average molecular weight of 341.38 g/mol. It has been found in or released from one recorded source: Electrical & Electronic Equipment (Antennas).
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC14H19N3O5S1
Average Molecular Mass341.380 g/mol
Monoisotopic Mass341.105 g/mol
CAS Registry Number35013-72-0
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C14H19N3O5S/c18-10-5-6-11(19)17(10)22-12(20)4-2-1-3-9-13-8(7-23-9)15-14(21)16-13/h8-9,13H,1-7H2,(H2,15,16,21)/t8-,9-,13-/m0/s1
InChI KeyYMXHPSHLTSZXKH-RVBZMBCESA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity Values
Toxicity ValueUnitValue RangeOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalReference
5243.0Log mg/kg[2900:9300]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
506AntennasElectrical & Electronic EquipmentNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Platelet glycoprotein 4 structureClick to view 3D structurePlatelet glycoprotein 4P16671HumansPredicted (SEA)5.3716
Click to view 3D structure1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase delta-1P10688Rattus norvegicusPredicted (SEA)2.56902
Click to view 3D structure1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase delta-1P51178HumansPredicted (SEA)2.56902
GRB10-interacting GYF protein 2 structureClick to view 3D structureGRB10-interacting GYF protein 2Q6Y7W6HumansPredicted (SEA)10.3539
Click to view 3D structureBiotin--protein ligaseP50747HumansPredicted (SEA)2.95827
Click to view 3D structureBirA bifunctional proteinP96884Mycobacterium tuberculosis (strain CDC 1551 / Oshkosh)Predicted (SEA)14.9471
Click to view 3D structureBiotin--[acetyl-CoA-carboxylase] ligaseI6YFP0Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)Predicted (SEA)27.87
NADPH oxidase organizer 1 structureClick to view 3D structureNADPH oxidase organizer 1Q8NFA2HumansPredicted (SEA)8.17417
E3 ubiquitin-protein ligase RNF168 structureClick to view 3D structureE3 ubiquitin-protein ligase RNF168Q8IYW5HumansPredicted (SEA)18.3724
Bifunctional ligase/repressor BirA structureClick to view 3D structureBifunctional ligase/repressor BirAP06709Escherichia coli (strain K12)Predicted (SEA)44.2962
Click to view 3D structureNonstructural protein 1Q194T2Influenza A virusPredicted (SEA)453.394
Click to view 3D structureBifunctional ligase/repressor BirAA0A0E7NXW5Staphylococcus aureusPredicted (SEA)10.5875
Streptavidin structureClick to view 3D structureStreptavidinP22629Streptomyces avidiniiPredicted (SEA)3.19182
Click to view 3D structureLymphocyte antigen 6KQ17RY6HumansPredicted (SEA)57.9198
Click to view 3D structureCytohesin-3P97696Rattus norvegicusPredicted (SEA)3.11397
Insulin-degrading enzyme structureClick to view 3D structureInsulin-degrading enzymeP14735HumansPredicted (SEA)273.874
Fanconi anemia group F protein structureClick to view 3D structureFanconi anemia group F proteinQ9NPI8HumansPredicted (SEA)5.91654
Prostaglandin E2 receptor EP4 subtype structureClick to view 3D structureProstaglandin E2 receptor EP4 subtypeP35408HumansPredicted (SEA)3602.47
Prostaglandin E2 receptor EP2 subtype structureClick to view 3D structureProstaglandin E2 receptor EP2 subtypeP43116HumansPredicted (SEA)3586.98
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)7087.32
Histone deacetylase 1 structureClick to view 3D structureHistone deacetylase 1Q13547HumansPredicted (SEA)6590.25
DNA-directed DNA/RNA polymerase mu structureClick to view 3D structureDNA-directed DNA/RNA polymerase muQ9NP87HumansPredicted (SEA)204.51
Click to view 3D structureDNA nucleotidylexotransferaseP06526Bos taurusPredicted (SEA)204.51
Click to view 3D structureProstaglandin E2 receptor EP1 subtypeP34995HumansPredicted (SEA)3754.2
Click to view 3D structureCytochrome P450 2C23P24470Rattus norvegicusPredicted (SEA)31.1397
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available