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Compounds

COMPOUND NPA027242

STRUCTURE

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PROPERTIES

NPAID	NPA027242
CLUSTER ID	283
NODE ID	257
NAME	Aeruginosin LH650B
FORMULA	C31H47ClN6O7
MOLECULAR WEIGHT (Da)	651.2050
ACCURATE MASS (Da)	650.3195
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Microcystis
ORIGIN SPECIES	sp.
InChIKey	KSOHSUTZQAOLGJ-LJDKEDMTSA-N
InChI	InChI=1S/C31H47ClN6O7/c1-16(2)11-22(36-28(43)26(41)13-17-6-9-25(40)20(32)12-17)29(44)38-23-15-19(39)8-7-18(23)14-24(38)27(42)35-21-5-4-10-37(31(33)34)30(21)45-3/h6,9,12,16,18-19,21-24,26,30,39-41H,4-5,7-8,10-11,13-15H2,1-3H3,(H3,33,34)(H,35,42)(H,36,43)/t18-,19+,21-,22+,23-,24-,26+,30-/m0/s1
SMILES	CO[C@H]1[C@@H](NC(=O)[C@@H]2C[C@@H]3CC[C@@H](O)C[C@@H]3N2C(=O)[C@@H](CC(C)C)NC(=O)[C@H](O)CC2=CC(Cl)=C(O)C=C2)CCCN1C(=N)N

ORIGINAL ISOLATION REFERENCE

CITATION	Vegman M; Carmeli S Three aeruginosins and a microviridin from a bloom assembly of Microcystis spp. collected from a fishpond near Kibbutz Lehavot HaBashan, Israel Tetrahedron 2014 70 (38) 6817-6824.
DOI	10.1016/j.tet.2014.07.057	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Chroococcales	LPSN	1118
Family	Microcystaceae	LPSN	1890449
Genus	Microcystis	LPSN	1125

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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