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Compounds

COMPOUND NPA011048

STRUCTURE

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PROPERTIES

NPAID	NPA011048
CLUSTER ID	4323
NODE ID	3187
NAME	Neoaspergillic acid
FORMULA	C12H20N2O2
MOLECULAR WEIGHT (Da)	224.3040
ACCURATE MASS (Da)	224.1525
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	sclerotiorum
InChIKey	DNJZKZJAZHFYQY-UHFFFAOYSA-N
InChI	InChI=1S/C12H20N2O2/c1-8(2)5-10-7-13-11(6-9(3)4)12(15)14(10)16/h7-9,15H,5-6H2,1-4H3
SMILES	CC(C)CC1=C(O)N(=O)=C(CC(C)C)C=N1

ORIGINAL ISOLATION REFERENCE

CITATION	Micetich, R g; Macdonald, J c BIOSYNTHESIS OF NEOASPERGILLIC AND NEOHYDROXYASPERGILLIC ACIDS Journal of Biological Chemistry 1965 240 1692-1695.
DOI	10.5281/zenodo.3541275	PMID	14285509

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Aspergillus	MycoBank	5052

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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