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Compounds

COMPOUND NPA001113

STRUCTURE

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PROPERTIES

NPAID	NPA001113
CLUSTER ID	763
NODE ID	452
NAME	Scytonine
FORMULA	C31H22N2O6
MOLECULAR WEIGHT (Da)	518.5250
ACCURATE MASS (Da)	518.1478
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Cyanobacterium
ORIGIN SPECIES	scytonema sp
InChIKey	RBULROHCVWCNGA-HMMYKYKNSA-N
InChI	InChI=1S/C31H22N2O6/c1-38-30(36)20(15-16-11-13-17(34)14-12-16)27-23(18-7-3-5-9-21(18)32-27)25-26(31(37)39-2)24-19-8-4-6-10-22(19)33-28(24)29(25)35/h3-15,32-34H,1-2H3/b20-15+
SMILES	COC(=O)C1=C(C(=O)C2=C1C3=CC=CC=C3N2)C4=C(NC5=CC=CC=C54)/C(=C\C6=CC=C(C=C6)O)/C(=O)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Bultel-Ponce; Felix-Theodose; Sarthou; Ponge; Bodo New Pigments from the Terrestrial Cyanobacterium Scytonema sp. Collected on the Mitaraka Inselberg, French Guyana Journal of Natural Products 2004 67 (4) 678-681.
DOI	10.1021/np034031u	PMID	15104503

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Chroococcales	LPSN	1118
Family	Cyanobacteriaceae	LPSN	-
Genus	Cyanobacterium	LPSN	102234

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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