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Compounds

COMPOUND NPA017810

STRUCTURE

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PROPERTIES

NPAID	NPA017810
CLUSTER ID	26
NODE ID	25
NAME	9ξ-O-2(2,3-dimethylbut-3-enyl)brevianamide Q
FORMULA	C27H33N3O3
MOLECULAR WEIGHT (Da)	447.5790
ACCURATE MASS (Da)	447.2522
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	versicolor
InChIKey	FRBBRXZVWXUWHM-UHFFFAOYSA-N
InChI	InChI=1S/C27H33N3O3/c1-8-25(4,5)22-19(18-12-9-10-13-20(18)28-22)16-21-23(31)30-15-11-14-27(30,24(32)29-21)33-26(6,7)17(2)3/h8-10,12-13,16,28H,1-2,11,14-15H2,3-7H3,(H,29,32)
SMILES	CC(=C)C(C)(C)OC12CCCN1C(=O)C(=CC3=C(NC4=CC=CC=C43)C(C)(C)C=C)NC2=O

ORIGINAL ISOLATION REFERENCE

CITATION	Miao, Feng-Ping; Li, Xiao-Dong; Liu, Xiang-Hong; Cichewicz, Robert H.; Ji, Nai-Yun Secondary Metabolites from an Algicolous Aspergillus versicolor Strain Marine Drugs 2012 10 (12) 131-139.
DOI	10.3390/md10010131	PMID	22363226

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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