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Compounds

COMPOUND NPA027321

STRUCTURE

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PROPERTIES

NPAID	NPA027321
CLUSTER ID	8251
NODE ID	5604
NAME	Mirabilene F isonitrile
FORMULA	C27H47NO5
MOLECULAR WEIGHT (Da)	465.6750
ACCURATE MASS (Da)	465.3454
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Scytonema
ORIGIN SPECIES	mirabilis BY-8-1
InChIKey	ZPVKYVUDKSAXRS-GKAJUAEBSA-N
InChI	InChI=1S/C27H47NO5/c1-11-12-23(29-6)16-24(30-7)17-25(31-8)18-26(32-9)19-27(33-10)21(3)15-20(2)13-14-22(4)28-5/h11,13,15,22-27H,1,12,14,16-19H2,2-4,6-10H3/b20-13+,21-15+/t22-,23-,24-,25-,26-,27-/m0/s1
SMILES	[C-]#[N+][C@@H](C)C/C=C(C)/C=C(\C)[C@H](C[C@H](C[C@H](C[C@H](C[C@H](CC=C)OC)OC)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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