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Compounds

COMPOUND NPA012438

STRUCTURE

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PROPERTIES

NPAID	NPA012438
CLUSTER ID	994
NODE ID	856
NAME	De-12-N-methyl-thaxtomin A
FORMULA	C21H20N4O6
MOLECULAR WEIGHT (Da)	424.4130
ACCURATE MASS (Da)	424.1383
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	scabies
InChIKey	SQRZSSRGQBFFGK-HRAATJIYSA-N
InChI	InChI=1S/C21H20N4O6/c1-24-19(27)16(9-13-11-22-15-6-3-7-17(18(13)15)25(30)31)23-20(28)21(24,29)10-12-4-2-5-14(26)8-12/h2-8,11,16,22,26,29H,9-10H2,1H3,(H,23,28)/t16-,21+/m0/s1
SMILES	CN1C(=O)[C@@H](NC(=O)[C@@]1(CC2=CC(=CC=C2)O)O)CC3=CNC4=C3C(=CC=C4)[N+](=O)[O-]

ORIGINAL ISOLATION REFERENCE

CITATION	King, Russell R.; Lawrence, C. Harold Characterization of New Thaxtomin A Analogues Generatedin VitrobyStreptomyces scabies Journal of Agricultural and Food Chemistry 1996 44 (4) 1108-1110.
DOI	10.1021/jf950243o	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptomycetales	LPSN	85011
Family	Streptomycetaceae	LPSN	2062
Genus	Streptomyces	LPSN	1883

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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