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Compounds

COMPOUND NPA028810

STRUCTURE

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PROPERTIES

NPAID	NPA028810
CLUSTER ID	283
NODE ID	257
NAME	Spumigin 582b
FORMULA	C30H42N6O6
MOLECULAR WEIGHT (Da)	582.7020
ACCURATE MASS (Da)	582.3166
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Nodularia
ORIGIN SPECIES	spumigena
InChIKey	NLJRMAAFNUDGBC-LMOYGDGSSA-N
InChI	InChI=1S/C30H42N6O6/c1-19-16-25(27(40)33-14-2-3-15-34-30(31)32)36(18-19)29(42)24(13-8-20-4-9-22(37)10-5-20)35-28(41)26(39)17-21-6-11-23(38)12-7-21/h4-7,9-12,19,24-26,37-39H,2-3,8,13-18H2,1H3,(H,33,40)(H,35,41)(H4,31,32,34)/t19?,24-,25?,26+/m0/s1
SMILES	CC1CC(C(=O)NCCCCN=C(N)N)N(C(=O)[C@H](CCC2=CC=C(O)C=C2)NC(=O)[C@H](O)CC2=CC=C(O)C=C2)C1

ORIGINAL ISOLATION REFERENCE

CITATION	Mazur-Marzec H; Bertos-Fortis M; Toruńska-Sitarz A; Fidor A; Legrand C Chemical and Genetic Diversity of Nodularia spumigena from the Baltic Sea. Marine Drugs 2016 14 (11) None.
DOI	10.3390/md14110209	PMID	27834904

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Nostocales	LPSN	1161
Family	Aphanizomenonaceae	LPSN	1892259
Genus	Nodularia	LPSN	159191

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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