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Compounds

COMPOUND NPA025696

STRUCTURE

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PROPERTIES

NPAID	NPA025696
CLUSTER ID	7773
NODE ID	5299
NAME	Szentirazine
FORMULA	C16H15N5O4
MOLECULAR WEIGHT (Da)	341.3270
ACCURATE MASS (Da)	341.1124
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Xenorhabdus
ORIGIN SPECIES	szentirmaii‐Δhfq
InChIKey	PVGDIYLDSVXOJN-QJGQKNTRSA-N
InChI	InChI=1S/C16H15N5O4/c17-16(25)21-13(22)6-12-15(24)19-11(14(23)20-12)5-8-7-18-10-4-2-1-3-9(8)10/h1-5,7,12,18H,6H2,(H,19,24)(H,20,23)(H3,17,21,22,25)/b11-5-/t12-/m0/s1
SMILES	NC(=O)NC(=O)C[C@@H]1NC(=O)/C(=C/C2=C[NH]C3=CC=CC=C23)NC1=O

ORIGINAL ISOLATION REFERENCE

CITATION	Bode, Edna; Heinrich, Antje K.; Hirschmann, Merle; Abebew, Desalegne; Shi, Yan-Ni; Vo, Tien Duy; Wesche, Frank; Shi, Yi-Ming; Grün, Peter; Simonyi, Svenja; Keller, Nadine; Engel, Yvonne; Wenski, Sebastian; Bennet, Reuel; Beyer, Sophie; Bischoff, Iris; Buaya, Anthony; Brandt, Sophie; Cakmak, Ibrahim; Çimen, Harun; Eckstein, Simone; Frank, Denia; Fürst, Robert; Gand, Martin; Geisslinger, Gerd; Hazir, Selcuk; Henke, Marina; Heermann, Ralf; Lecaudey, Virginie; Schäfer, Wilhelm; Schiffmann, Susanne; Schüffler, Anja; Schwenk, Rebecca; Skaljac, Marisa; Thines, Eckhard; Thines, Marco; Ulshöfer, Thomas; Vilcinskas, Andreas; Wichelhaus, Thomas A.; Bode, Helge B. Promoter Activation in Δhfq Mutants as an Efficient Tool for Specialized Metabolite Production Enabling Direct Bioactivity Testing Angewandte Chemie International Edition 2019 58 (52) 18957-18963.
DOI	10.1002/anie.201910563	PMID	31693786

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Proteobacteria	LPSN	1224
Class	Gammaproteobacteria	LPSN	1236
Order	Enterobacterales	LPSN	91347
Family	Morganellaceae	LPSN	1903414
Genus	Xenorhabdus	LPSN	626

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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