Record Information
Version1.0
Creation date2015-10-09 22:31:56 UTC
Update date2017-01-19 02:36:32 UTC
FoodComEx IDPC000681
FoodDB RecordFDB022963
Chemical Information
Name1,11-Undecanedicarboxylic acid
DescriptionUndecanedicarboxylic acid is an unusual odd-numbered dicarboxylic acid that appears in the urines of children with neonatal adrenoleukodystrophy and Zellweger syndrome, as an additional marker of these peroxisomal disorders. (PMID: 2943344) [HMDB]
CAS Number505-52-2
Structure
Thumb
Synonyms
SynonymSource
1,11-Undecanedicarboxylatehmdb
1,13-Tridecanedioatehmdb
1,13-Tridecanedioic acidhmdb
Brassilatehmdb
Brassilic acidhmdb
Brassylatehmdb
Brassylic acidhmdb
Tridecanedioatehmdb
Tridecanedioic acidhmdb
Undecane-1,11-dicarboxylatehmdb
Undecane-1,11-dicarboxylic acidhmdb
Chemical FormulaC13H24O4
IUPAC nametridecanedioic acid
InChI IdentifierInChI=1S/C13H24O4/c14-12(15)10-8-6-4-2-1-3-5-7-9-11-13(16)17/h1-11H2,(H,14,15)(H,16,17)
InChI KeyDXNCZXXFRKPEPY-UHFFFAOYSA-N
Isomeric SMILESOC(=O)CCCCCCCCCCCC(O)=O
Average Molecular Weight244.3273
Monoisotopic Molecular Weight244.167459256
Chemical Taxonomy
ClassificationNot classified
Physico-Chemical Properties - Experimental
PropertyValueReference
Experimental logPNot Available
Experimental Water SolubilityNot Available
Melting PointNot Available
Foods of Origin
FoodContent Range AverageReference
FoodReference
Production Data
Production Methodcommercial
Production Method ReferenceNot Available
Production Method Reference FileNot Available
Quantity AvailableProduction upon request, up to 200 mg
Delivery TimeNot Available
Storage Formsolid
Storage Conditions-80°C
StabilityNot Available
PurityNot Available
Spectra
Spectral Data Upon RequestNot Available
Provider Information
Contact NameContact InstitutionContact Email
Rosa Vazquez Fresnovazquezf@ualberta.ca
Commercial Vendors
AKSci M986
MetaSci HMDB0002327
Sigma-Aldrich HMDB0002327
Toronto Research Chemicals U787665