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Compounds

COMPOUND NPA027241

STRUCTURE

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PROPERTIES

NPAID	NPA027241
CLUSTER ID	283
NODE ID	257
NAME	Aeruginosin LH606
FORMULA	C29H43ClN6O6
MOLECULAR WEIGHT (Da)	607.1520
ACCURATE MASS (Da)	606.2933
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Microcystis
ORIGIN SPECIES	sp.
InChIKey	VTKSRNODZPGCEU-ZNLUQXHSSA-N
InChI	InChI=1S/C29H43ClN6O6/c1-15(2)10-20(33-27(41)24(39)12-16-5-8-23(38)19(30)11-16)28(42)36-21-14-18(37)7-6-17(21)13-22(36)26(40)34-25-4-3-9-35(25)29(31)32/h5,8,11,15,17-18,20-22,24-25,37-39H,3-4,6-7,9-10,12-14H2,1-2H3,(H3,31,32)(H,33,41)(H,34,40)/t17-,18+,20+,21-,22-,24+,25?/m0/s1
SMILES	CC(C)C[C@@H](NC(=O)[C@H](O)CC1=CC(Cl)=C(O)C=C1)C(=O)N1[C@H](C(=O)NC2CCCN2C(=N)N)C[C@@H]2CC[C@@H](O)C[C@@H]21

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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