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Compounds

COMPOUND NPA005272

STRUCTURE

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PROPERTIES

NPAID	NPA005272
CLUSTER ID	172
NODE ID	161
NAME	Terrequinone A
FORMULA	C32H30N2O3
MOLECULAR WEIGHT (Da)	490.6030
ACCURATE MASS (Da)	490.2256
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	terreus
InChIKey	NBSHFMWBYVHWNG-UHFFFAOYSA-N
InChI	InChI=1S/C32H30N2O3/c1-6-32(4,5)31-26(20-12-8-10-14-24(20)34-31)27-28(35)21(16-15-18(2)3)25(29(36)30(27)37)22-17-33-23-13-9-7-11-19(22)23/h6-15,17,33-35H,1,16H2,2-5H3
SMILES	CC(=CCC1=C(C(=O)C(=O)C(=C1O)C2=C(NC3=CC=CC=C32)C(C)(C)C=C)C4=CNC5=CC=CC=C54)C

ORIGINAL ISOLATION REFERENCE

CITATION	He, Jian; Wijeratne, E. M. Kithsiri; Bashyal, Bharat P.; Zhan, Jixun; Seliga, Christopher J.; Liu, Manping X.; Pierson, Elizabeth E.; Pierson III, Leland S.; VanEtten, Hans D.; Gunatilaka, A. A. Leslie Cytotoxic and other metabolites of Aspergillus inhabiting the rhizosphere of sonoran desert plants Journal of Natural Products 2004 67 (12) 1985-1991.
DOI	10.1021/np040139d	PMID	15620238

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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