BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

Glutaric Acid

Graphical representations:

Glutaric acid image

Molecular Formula: C5 H8 O4

Natural Isotopic Abundance Mass: 132.11462

Mono-Isotopic Molecular Masses:

  • C12N14: 132.0422587452
  • C13N14: 137.0590329342
  • C12N15: 132.0422587452
  • C13N15: 137.0590329342

InCHi String:

canonical and isomeric SMILES: C(CC(=O)O)CC(=O)O

PUBCHEM iupac NAME: PUBCHEM iupac SYSTEMATIC NAME
pentanedioic acid

PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME
glutaric acid

PubChem Substance (SID):   85165198   8143978   7989203
PubChem Compound (CID):   743
KEGG: Compound ID   C00489
CAS Registry IDs:   68937-69-9   68603-87-2   8065-59-6   110-94-1
PDB Chemical Component   GUA
Miscellaneous Databases and IDs:   Sigma-Aldrich G3407_ALDRICH   ChEBI CHEBI:17859   BioCyc GLUTARATE   ChemIDplus 068603872   ChemSpider 11220387   MMDB 10189.10   EINECS 273-081-5   NMRShiftDB 10016798   CambridgeSoft Corporation 4054   EPA DSSTox 1654   LipidMAPS LMFA01170046   DrugBank DB03553   ChemDB 3969351   NIST Chemistry WebBook 2652803455

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.