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Compounds

COMPOUND NPA000729

STRUCTURE

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PROPERTIES

NPAID	NPA000729
CLUSTER ID	26
NODE ID	25
NAME	Fellutanine D
FORMULA	C32H36N4O4
MOLECULAR WEIGHT (Da)	540.6640
ACCURATE MASS (Da)	540.2737
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	fellutanum
InChIKey	CXDDBHFLLPBKRS-LXLBRPCYSA-N
InChI	InChI=1S/C32H36N4O4/c1-7-27(3,4)31-29(39,19-13-9-11-15-21(19)33-31)17-23-26(38)36-24(25(37)35(23)31)18-30(40)20-14-10-12-16-22(20)34-32(30,36)28(5,6)8-2/h7-16,23-24,33-34,39-40H,1-2,17-18H2,3-6H3/t23-,24+,29+,30-,31-,32+
SMILES	CC(C)(C=C)[C@@]12[C@@](C[C@@H]3N1C(=O)[C@H]4C[C@@]5(C6=CC=CC=C6N[C@@]5(N4C3=O)C(C)(C)C=C)O)(C7=CC=CC=C7N2)O

ORIGINAL ISOLATION REFERENCE

CITATION	Kozlovsky, Anatoly G.; Vinokurova, Nataliya G.; Adanin, Vladimir M.; Burkhardt, Guenther; Dahse, Hans-Martin; Graefe, Udo New diketopiperazine alkaloids from Penicillium fellutanum Journal of Natural Products 2000 63 (5) 698-700.
DOI	10.1021/np9903853	PMID	10843594

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	Penicillium	MycoBank	5073

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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