EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:132262 - (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid

ChEBI IDCHEBI:132262
ChEBI Name(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid
Stars
ASCII Name(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid
DefinitionA member of the class of phenazines that is 1,4,10,10a-tetrahydrophenazine substituted at positions 1 and 6 by carboxy groups (the 1R,10aS-diastereomer).
Last Modified21 June 2016
SubmitterSteve
DownloadsMolfile
FormulaC14H12N2O4
Net Charge0
Average Mass272.260
Monoisotopic Mass272.07971
SMILES[H][C@@]12Nc3cccc(C(=O)O)c3N=C1CC=C[C@H]2C(=O)O
InChIInChI=1S/C14H12N2O4/c17-13(18)7-3-1-5-9-11(7)16-10-6-2-4-8(14(19)20)12(10)15-9/h1-5,8,12,15H,6H2,(H,17,18)(H,19,20)/t8-,12+/m1/s1
InChIKeyCUYPWOPOBAHCCE-PELKAZGASA-N
Species of MetaboliteComponentSourceComments
Pseudomonas fluorescens (ncbitaxon:294) - PubMed (23897464) Strain: 2-79
Burkholderia lata (ncbitaxon:482957) - PubMed (23897464) Strain: 383
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid (CHEBI:132262) has role bacterial metabolite (CHEBI:76969)
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid (CHEBI:132262) is a amino dicarboxylic acid (CHEBI:36164)
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid (CHEBI:132262) is a phenazines (CHEBI:39201)
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid (CHEBI:132262) is conjugate acid of (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylate (CHEBI:131973)
Incoming Relation(s)
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylate (CHEBI:131973) is conjugate base of (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid (CHEBI:132262)
IUPAC Name 
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid
Manual XrefsDatabases
CPD-19103MetaCyc
Citations