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Compounds

COMPOUND NPA002502

STRUCTURE

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PROPERTIES

NPAID	NPA002502
CLUSTER ID	1466
NODE ID	1209
NAME	N-Demethylsambutoxin
FORMULA	C27H37NO4
MOLECULAR WEIGHT (Da)	439.5960
ACCURATE MASS (Da)	439.2723
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Fusarium
ORIGIN SPECIES	oxysporum
InChIKey	YDGOHTBOOYAVOP-JYCRKZTRSA-N
InChI	InChI=1S/C27H37NO4/c1-6-16(2)13-17(3)14-19(5)26-18(4)7-12-23(32-26)24-25(30)22(15-28-27(24)31)20-8-10-21(29)11-9-20/h8-11,14-18,23,26,29H,6-7,12-13H2,1-5H3,(H2,28,30,31)/b19-14+/t16-,17+,18+,23-,26+/m0/s1
SMILES	CC[C@H](C)C[C@@H](C)/C=C(\C)/[C@H]1[C@@H](CC[C@H](O1)C2=C(C(=CNC2=O)C3=CC=C(C=C3)O)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Jayasinghe, Lalith; Abbas, Hamed K.; Jacob, Melissa R.; Herath, Wimal H. M. W.; Dhammika Nanayakkara N-methyl-4-hydroxy-2-pyridinone analogues from Fusarium oxysporum Journal of Natural Products 2006 69 (3) 439-442.
DOI	10.1021/np050487v	PMID	16562855

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Hypocreales	MycoBank	5125
Family	Nectriaceae	MycoBank	110618
Genus	Fusarium	MycoBank	5506

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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