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CHEBI:176942 - (1R,5aS,6R)-4a-Hydroxy-1,4,4a,5,5a,6,9,10a-octahydrophenazine-1,6-dicarboxylate

ChEBI IDCHEBI:176942
ChEBI Name(1R,5aS,6R)-4a-Hydroxy-1,4,4a,5,5a,6,9,10a-octahydrophenazine-1,6-dicarboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16N2O5
Net Charge0
Average Mass292.291
Monoisotopic Mass292.10592
SMILES[H][C@@]12NC3(O)CC=C[C@@H](C(=O)O)C3N=C1CC=C[C@H]2C(=O)O
InChIInChI=1S/C14H16N2O5/c17-12(18)7-3-1-5-9-10(7)16-14(21)6-2-4-8(13(19)20)11(14)15-9/h1-4,7-8,10-11,16,21H,5-6H2,(H,17,18)(H,19,20)/t7-,8-,10+,11?,14?/m1/s1
InChIKeyIZJBZSNXJLOCHK-VMHMYJSPSA-N
Species of MetaboliteComponentSourceComments
Streptococcus mutans (ncbitaxon:1309) biofilm (BTO:0002690) MetaboLights (MTBLS3020) Strain: Streptococcus mutans UA159 [NCBI:txid210007]
ChEBI Ontology
Outgoing Relation(s)
(1R,5aS,6R)-4a-Hydroxy-1,4,4a,5,5a,6,9,10a-octahydrophenazine-1,6-dicarboxylate (CHEBI:176942) is a phenazines (CHEBI:39201)
IUPAC Name 
(1R,5aS,6R)-4a-hydroxy-4,5,5a,6,9,10a-hexahydro-1H-phenazine-1,6-dicarboxylic acid
Manual XrefsDatabases
C21473KEGG COMPOUND