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Compounds

COMPOUND NPA002681

STRUCTURE

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PROPERTIES

NPAID	NPA002681
CLUSTER ID	1145
NODE ID	978
NAME	Bischloroanthrabenzoxocinone
FORMULA	C28H24Cl2O7
MOLECULAR WEIGHT (Da)	543.3990
ACCURATE MASS (Da)	542.0899
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. (MA6657)
InChIKey	ZGJMIZXNGYVIRM-UHFFFAOYSA-N
InChI	InChI=1S/C28H24Cl2O7/c1-10-6-12(35-5)8-14-15(10)26-16-11(9-28(4,36-14)37-26)7-13-17(22(16)31)23(32)18-19(27(13,2)3)20(29)25(34)21(30)24(18)33/h6-8,26,31,33-34H,9H2,1-5H3
SMILES	CC1=CC(=CC2=C1C3C4=C(CC(O3)(O2)C)C=C5C(=C4O)C(=O)C6=C(C5(C)C)C(=C(C(=C6O)Cl)O)Cl)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Herath, Kithsiri B; Jayasuriya, Hiranthi; Guan, Ziqiang; Schulman, Marvin; Ruby, Carolyn; Sharma, Neelam; MacNaul, Karen; Menke, John G; Kodali, Srinivas; Galgoci, Andrew; Wang, Jun; Singh, Sheo B Anthrabenzoxocinones from Streptomyces sp. as liver X receptor ligands and antibacterial agents Journal of Natural Products 2005 68 (9) 1437-1440.
DOI	10.1021/np050176k	PMID	16180833

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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