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Compounds

COMPOUND NPA027320

STRUCTURE

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PROPERTIES

NPAID	NPA027320
CLUSTER ID	8252
NODE ID	5605
NAME	Mirabilene E isonitrile
FORMULA	C24H39NO4
MOLECULAR WEIGHT (Da)	405.5790
ACCURATE MASS (Da)	405.2879
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Scytonema
ORIGIN SPECIES	mirabilis BY-8-1
InChIKey	IBWHSOUJBPQKSP-GZFUUHCPSA-N
InChI	InChI=1S/C24H39NO4/c1-9-10-21(26-5)14-22(27-6)15-23(28-7)16-24(29-8)20(4)13-18(2)11-12-19(3)17-25/h9,12-13,21-24H,1,4,10-11,14-16H2,2-3,5-8H3/b18-13-,19-12+/t21-,22-,23-,24-/m0/s1
SMILES	C=CC[C@@H](C[C@@H](C[C@@H](C[C@H](OC)C(=C)/C=C(/C)C/C=C(\C)C#N)OC)OC)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Carmeli S; Moore R; Patterson G; Mori Y; Suzuki M Isonitriles from the blue-green alga Scytonema mirabile Journal of Organic Chemistry 1990 55 (14) 4431-4438.
DOI	10.1021/jo00301a041	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Nostocales	LPSN	1161
Family	Scytonemataceae	LPSN	1182
Genus	Scytonema	LPSN	1203

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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