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Compounds

COMPOUND NPA029874

STRUCTURE

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PROPERTIES

NPAID	NPA029874
CLUSTER ID	1027
NODE ID	885
NAME	2-oxo-3(R)-hydroxy-13-N-desmethyl-lyngbyatoxin A
FORMULA	C26H37N3O4
MOLECULAR WEIGHT (Da)	455.5990
ACCURATE MASS (Da)	455.2784
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Moorea
ORIGIN SPECIES	producens
InChIKey	IYWSJDFNYQWKPV-URWKRNFESA-N
InChI	InChI=1S/C26H37N3O4/c1-7-25(6,12-8-9-15(2)3)18-10-11-19-20-22(18)29-24(32)26(20,33)13-17(14-30)27-23(31)21(28-19)16(4)5/h7,9-11,16-17,21,28,30,33H,1,8,12-14H2,2-6H3,(H,27,31)(H,29,32)/t17-,21-,25-,26+/m0/s1
SMILES	C=C[C@@](C)(CCC=C(C)C)C1=C2NC(=O)[C@@]3(O)C[C@@H](CO)NC(=O)[C@H](C(C)C)NC(=C23)C=C1

ORIGINAL ISOLATION REFERENCE

CITATION	Jiang, W; Tan, S; Hanaki, Y; Irie, K; Uchida, H; Watanabe, R; Suzuki, T; Sakamoto, B; Kamio, M; Nagai, H Two new lyngbyatoxin derivatives from the Cyanobacterium, Moorea producens. Marine Drugs 2014 12 (12) 5788-5800.
DOI	10.3390/md12125788	PMID	25470181

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Oscillatoriales	LPSN	1150
Family	Oscillatoriaceae	LPSN	1892254
Genus	Moorea	LPSN	1155738

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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