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Compounds

COMPOUND NPA016872

STRUCTURE

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PROPERTIES

NPAID	NPA016872
CLUSTER ID	148
NODE ID	140
NAME	8-Acetamido-1,1,1,15,15-pentachloropentadeca-3,12-diyne
FORMULA	C17H22Cl5NO
MOLECULAR WEIGHT (Da)	433.6340
ACCURATE MASS (Da)	431.0144
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Microcoleus
ORIGIN SPECIES	lyngbyaceus
InChIKey	PHCUUSBWIFRVFM-UHFFFAOYSA-N
InChI	InChI=1S/C17H22Cl5NO/c1-14(24)23-15(10-6-2-3-8-12-16(18)19)11-7-4-5-9-13-17(20,21)22/h15-16H,2,4,6-7,10-13H2,1H3,(H,23,24)
SMILES	CC(=O)NC(CCCC#CCC(Cl)Cl)CCCC#CCC(Cl)(Cl)Cl

ORIGINAL ISOLATION REFERENCE

CITATION	Orsini, Michael A.; Pannell, Lewis K.; Erickson, Karen L. Polychlorinated acetamides from the cyanobacterium Microcoleus lyngbyaceus Journal of Natural Products 2001 64 (5) 572-577.
DOI	10.1021/np000452p	PMID	11374946

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Oscillatoriales	LPSN	1150
Family	Microcoleaceae	LPSN	1892252
Genus	Microcoleus	LPSN	44471

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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