Astromicin B (CED0017654)

Record Information
Version1.0
Creation Date2026-03-31 20:25:01 UTC
Update Date2026-05-20 19:26:10 UTC
Accession NumberCHEM057756
Identification
Common NameAstromicin B
ClassSmall Molecule
Description
Astromicin B is an organic compound with the formula C15H32N4O5 and an average molecular weight of 348.44 g/mol. Astromicin B belongs to the carbohydrates and carbohydrate conjugates, a subclass of organooxygen compounds within the organic compounds. This substance is found in or released from one recorded source: healthcare, pharmaceuticals & veterinary products (Antibiotics). Recorded exposure routes for this compound include inhalation and oral administration.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC15H32N4O5
Average Molecular Mass348.444 g/mol
Monoisotopic Mass348.237 g/mol
CAS Registry Number54783-95-8
IUPAC NameNot Available
Traditional NameNot Available
SMILESCN[C@H]1[C@@H](O)[C@H](O[C@H]2O[C@@H](CC[C@H]2N)[C@H](C)N)[C@@H](N)[C@H](O)[C@@H]1OC
InChI IdentifierInChI=1S/C15H32N4O5/c1-6(16)8-5-4-7(17)15(23-8)24-13-9(18)11(20)14(22-3)10(19-2)12(13)21/h6-15,19-21H,4-5,16-18H2,1-3H3/t6-,7+,8-,9-,10-,11-,12+,13+,14+,15+/m0/s1
InChI KeyWFMQYKIRAVMXSU-LCVFDZPESA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as aminocyclitol glycosides. These are organic compounds containing an amicocyclitol moiety glycosidically linked to a carbohydrate moiety. There are two major classes of aminoglycosides containing a 2-streptamine core. They are called 4,5- and 4,6-disubstituted 2-deoxystreptamines.
KingdomOrganic compounds
Super ClassOrganic oxygen compounds
ClassOrganooxygen compounds
Sub ClassCarbohydrates and carbohydrate conjugates
Direct ParentAminocyclitol glycosides
Alternative Parents
Substituents
  • Amino cyclitol glycoside
  • Aminocyclitol or derivatives
  • Cyclohexanol
  • Cyclohexylamine
  • Cyclitol or derivatives
  • Oxane
  • Cyclic alcohol
  • 1,2-aminoalcohol
  • Secondary alcohol
  • Ether
  • Secondary aliphatic amine
  • Dialkyl ether
  • Secondary amine
  • Organoheterocyclic compound
  • Oxacycle
  • Acetal
  • Organonitrogen compound
  • Primary aliphatic amine
  • Hydrocarbon derivative
  • Organopnictogen compound
  • Organic nitrogen compound
  • Amine
  • Alcohol
  • Primary amine
  • Aliphatic heteromonocyclic compound
Molecular FrameworkAliphatic heteromonocyclic compounds
External Descriptors
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
5800.0Log mg/kg[3300:10000]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
306AntibioticsHealthcare, pharmaceuticals & veterinary productsNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Gap junction beta-2 protein structureClick to view 3D structureGap junction beta-2 proteinP29033HumansPredicted (SEA)4.5931
Gap junction alpha-1 protein structureClick to view 3D structureGap junction alpha-1 proteinP17302HumansPredicted (SEA)5.60514
Click to view 3D structureHuman immunodeficiency virus type 1 REVQ77Y21Human immunodeficiency virus 1Predicted (SEA)1.32344
Endopolygalactyuronase structureClick to view 3D structureEndopolygalactyuronaseP79074Chondrostereum purpureumPredicted (SEA)2.80257
CD44 antigen structureClick to view 3D structureCD44 antigenP16070HumansPredicted (SEA)21.0971
CD44 antigen structureClick to view 3D structureCD44 antigenP15379Mus musculusPredicted (SEA)21.0971
Click to view 3D structureN-acetyllactosaminide alpha-1,3-galactosyltransferaseP50127Sus scrofaPredicted (SEA)87.5025
Beta-ketoacyl-[acyl-carrier-protein] synthase III structureClick to view 3D structureBeta-ketoacyl-[acyl-carrier-protein] synthase IIIP0A6R0Escherichia coli (strain K12)Predicted (SEA)5.76084
Fibronectin structureClick to view 3D structureFibronectinP02751HumansPredicted (SEA)11.9888
Heparanase structureClick to view 3D structureHeparanaseQ9Y251HumansPredicted (SEA)103.306
Click to view 3D structureAlpha-amylaseQ7M328Sus scrofa domesticusPredicted (SEA)17.5161
4-hydroxy-2-oxoglutarate aldolase, mitochondrial structureClick to view 3D structure4-hydroxy-2-oxoglutarate aldolase, mitochondrialQ86XE5HumansPredicted (SEA)23.1212
PA-I galactophilic lectin structureClick to view 3D structurePA-I galactophilic lectinQ05097Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 / 1C / PRS 101 / LMG12228)Predicted (SEA)26.6244
Click to view 3D structureNeuraminidaseB4URF0Influenza A virusPredicted (SEA)1234.3
Click to view 3D structureSialidaseP10481Clostridium perfringensPredicted (SEA)301.977
Neuraminidase structureClick to view 3D structureNeuraminidaseP03468Influenza A virus (A/Puerto Rico/8/1934(H1N1))Predicted (SEA)1681.23
Galectin-3 structureClick to view 3D structureGalectin-3P17931HumansPredicted (SEA)752.568
UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase structureClick to view 3D structureUDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferaseQ9H3H5HumansPredicted (SEA)513.727
HTH-type quorum-sensing regulator RhlR structureClick to view 3D structureHTH-type quorum-sensing regulator RhlRP54292Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 / 1C / PRS 101 / LMG12228)Predicted (SEA)285.084
Click to view 3D structureKiller cell lectin-like receptor subfamily B member 1AP27471Rattus norvegicusPredicted (SEA)55.6622
Neuraminidase structureClick to view 3D structureNeuraminidaseP03474Influenza B virus (strain B/Lee/1940)Predicted (SEA)636.34
Click to view 3D structureNeuraminidaseP03469Influenza A virus (strain A/USSR/90/1977 H1N1)Predicted (SEA)1703.89
Click to view 3D structurePhospho-N-acetylmuramoyl-pentapeptide-transferaseP9WMW7Mycobacterium tuberculosisPredicted (SEA)211.049
Endo-beta-N-acetylglucosaminidase structureClick to view 3D structureEndo-beta-N-acetylglucosaminidaseQ9ZB22Arthrobacter protophormiaePredicted (SEA)37.9904
Interferon gamma structureClick to view 3D structureInterferon gammaP01579HumansPredicted (SEA)10.8989
Concentrations
Not Available
External Links
DrugBank IDNot Available
HMDB IDNot Available
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDC00018138
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkNot Available
Chemspider IDNot Available
ChEBI IDNot Available
PubChem Compound ID5284518
Kegg Compound IDC17709
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References