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Compounds

COMPOUND NPA004596

STRUCTURE

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PROPERTIES

NPAID	NPA004596
CLUSTER ID	2373
NODE ID	1869
NAME	methyl (2,5-dihydroxy-3-nitrophenyl) acetate
FORMULA	C9H9NO6
MOLECULAR WEIGHT (Da)	227.1720
ACCURATE MASS (Da)	227.0430
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Pseudomonas
ORIGIN SPECIES	syringae
InChIKey	NBFISYVVWKCRKR-UHFFFAOYSA-N
InChI	InChI=1S/C9H9NO6/c1-16-8(12)3-5-2-6(11)4-7(9(5)13)10(14)15/h2,4,11,13H,3H2,1H3
SMILES	COC(=O)CC1=CC(=CC(=C1O)[N+](=O)[O-])O

ORIGINAL ISOLATION REFERENCE

CITATION	Evidente, Antonio; Iacobellis, Nicola S.; Impellizzeri, Antonino; Surico, Giuseppe Methyl (2,5-dihydroxy-3-nitrophenyl) acetate from Pseudomonas syringae pv. papulans Phytochemistry 1992 31 (12) 4105-4107.
DOI	10.1016/0031-9422(92)80422-b	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Proteobacteria	LPSN	1224
Class	Gammaproteobacteria	LPSN	1236
Order	Pseudomonadales	LPSN	72274
Family	Pseudomonadaceae	LPSN	135621
Genus	Pseudomonas	LPSN	286

CLASSYFIRE

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MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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