Record Information
Version1.0
StatusDetected and Quantified
Creation Date2022-05-16 19:46:25 UTC
Update Date2022-09-01 02:17:50 UTC
Metabolite IDMMDBc0050012
Metabolite Identification
Common Name(10aS)-10,10a-Dihydrophenazine-1-carboxylate
Description(10aS)-10,10a-dihydrophenazine-1-carboxylic acid belongs to the class of organic compounds known as phenazines and derivatives. These are polycyclic aromatic compounds containing a phenazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a pyrazine ring (10aS)-10,10a-dihydrophenazine-1-carboxylic acid is a moderately basic compound (based on its pKa).
Structure
Synonyms
ValueSource
(10AS)-10,10a-dihydrophenazine-1-carboxylateGenerator
Molecular FormulaC13H10N2O2
Average Mass226.235
Monoisotopic Mass226.07422757
IUPAC Name(10aS)-10,10a-dihydrophenazine-1-carboxylic acid
Traditional Name(10aS)-10,10a-dihydrophenazine-1-carboxylic acid
CAS Registry NumberNot Available
SMILES
[H][C@@]12NC3=C(C=CC=C3)N=C1C=CC=C2C(O)=O
InChI Identifier
InChI=1S/C13H10N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7,12,15H,(H,16,17)/t12-/m0/s1
InChI KeyXMQOCNWUNJVNBJ-LBPRGKRZSA-N