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Compounds

COMPOUND NPA007452

STRUCTURE

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PROPERTIES

NPAID	NPA007452
CLUSTER ID	3259
NODE ID	11
NAME	AT2433-A5
FORMULA	C21H12ClN3O2
MOLECULAR WEIGHT (Da)	373.7990
ACCURATE MASS (Da)	373.0618
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Actinomadura
ORIGIN SPECIES	melliaura ATCC 39691
InChIKey	BPZVYXQGAYYXGA-UHFFFAOYSA-N
InChI	InChI=1S/C21H12ClN3O2/c1-25-20(26)15-13-9-5-2-3-8-12(9)23-18(13)19-14(16(15)21(25)27)10-6-4-7-11(22)17(10)24-19/h2-8,23-24H,1H3
SMILES	CN1C(=O)C2=C3C4=C(C(=CC=C4)Cl)NC3=C5C(=C2C1=O)C6=CC=CC=C6N5

ORIGINAL ISOLATION REFERENCE

CITATION	Shaaban, Khaled A.; Elshahawi, Sherif I.; Wang, Xiachang; Horn, Jamie; Kharel, Madan K.; Leggas, Markos; Thorson, Jon S. Cytotoxic Indolocarbazoles from Actinomadura melliaura ATCC 39691 Journal of Natural Products 2015 78 (7) 1723-1729.
DOI	10.1021/acs.jnatprod.5b00429	PMID	26091285

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptosporangiales	LPSN	85012
Family	Thermomonosporaceae	LPSN	2012
Genus	Actinomadura	LPSN	1988

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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