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Compounds

COMPOUND NPA020084

STRUCTURE

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PROPERTIES

NPAID	NPA020084
CLUSTER ID	26
NODE ID	25
NAME	Neoechinulin D
FORMULA	C24H29N3O2
MOLECULAR WEIGHT (Da)	391.5150
ACCURATE MASS (Da)	391.2260
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	arnstelodarni
InChIKey	YCCLECFRSYOPML-HYTQYMIGSA-N
InChI	InChI=1S/C24H29N3O2/c1-7-24(5,6)21-18(13-20-23(29)25-15(4)22(28)27-20)17-11-10-16(9-8-14(2)3)12-19(17)26-21/h7-8,10-13,15,26H,1,9H2,2-6H3,(H,25,29)(H,27,28)/b20-13-/t15-/m0/s1
SMILES	C[C@H]1C(=O)N/C(=C\C2=C(NC3=C2C=CC(=C3)CC=C(C)C)C(C)(C)C=C)/C(=O)N1

ORIGINAL ISOLATION REFERENCE

CITATION	Marchelli, R; Dossena, A; Pochini, A; Dradi, E The structures of five new didehydropeptides related to neoechinulin, isolated from Aspergillus amstelodami Journal of the Chemical Society, Perkin Transactions 1 1977 0 (7) 713-717.
DOI	10.1039/P19770000713	PMID	-

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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