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Compounds

COMPOUND NPA027329

STRUCTURE

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PROPERTIES

NPAID	NPA027329
CLUSTER ID	8254
NODE ID	5607
NAME	Kimbeamide A
FORMULA	C17H23Cl2NO
MOLECULAR WEIGHT (Da)	328.2830
ACCURATE MASS (Da)	327.1157
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Symploca
ORIGIN SPECIES	sp.
InChIKey	VOWNHWSVEUWZQX-HUVZLFSQSA-N
InChI	InChI=1S/C17H23Cl2NO/c1-15(14-19)10-6-5-8-12-17(21)20-16(2)11-7-3-4-9-13-18/h5-9,11-14,16H,3-4,10H2,1-2H3,(H,20,21)/b6-5+,11-7-,12-8+,13-9+,15-14+/t16-/m0/s1
SMILES	C/C(=C\Cl)C/C=C/C=C/C(=O)N[C@@H](C)/C=C\CC/C=C/Cl

ORIGINAL ISOLATION REFERENCE

CITATION	Nunnery JK; Engene N; Byrum T; Cao Z; Jabba SV; Pereira AR; Matainaho T; Murray TF; Gerwick WH Biosynthetically intriguing chlorinated lipophilic metabolites from geographically distant tropical marine cyanobacteria. Journal of Organic Chemistry 2012 77 (9) 4198-4208.
DOI	10.1021/jo300160e	PMID	22489775

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	Symploca	LPSN	105591

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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