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Compounds

COMPOUND NPA027420

STRUCTURE

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PROPERTIES

NPAID	NPA027420
CLUSTER ID	283
NODE ID	257
NAME	Aeruginosin NOL3
FORMULA	C30H48N6O6
MOLECULAR WEIGHT (Da)	588.7500
ACCURATE MASS (Da)	588.3635
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Nodularia
ORIGIN SPECIES	spumigena AV1
InChIKey	KVEGLZCDCVSBQX-ZHYXHTNASA-N
InChI	InChI=1S/C30H48N6O6/c1-2-3-4-7-27(40)35-24(15-19-8-11-22(38)12-9-19)29(42)36-25-17-23(39)13-10-20(25)16-26(36)28(41)34-21(18-37)6-5-14-33-30(31)32/h8-9,11-12,20-21,23-26,37-39H,2-7,10,13-18H2,1H3,(H,34,41)(H,35,40)(H4,31,32,33)/t20-,21?,23?,24-,25-,26-/m0/s1
SMILES	CCCCCC(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1[C@H](C(=O)NC(CO)CCCN=C(N)N)C[C@@H]2CCC(O)C[C@@H]21

ORIGINAL ISOLATION REFERENCE

CITATION	Fewer DP; Jokela J; Paukku E; Österholm J; Wahlsten M; Permi P; Aitio O; Rouhiainen L; Gomez-Saez GV; Sivonen K New structural variants of aeruginosin produced by the toxic bloom forming cyanobacterium Nodularia spumigena. PLoS One 2013 8 (9) e73618.
DOI	10.1371/journal.pone.0073618	PMID	24040002

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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