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Compounds

COMPOUND NPA001866

STRUCTURE

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PROPERTIES

NPAID	NPA001866
CLUSTER ID	1175
NODE ID	1001
NAME	18Z-lyngbyaloside C
FORMULA	C28H45BrO10
MOLECULAR WEIGHT (Da)	621.5620
ACCURATE MASS (Da)	620.2196
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Lyngbya
ORIGIN SPECIES	bouillonii
InChIKey	DFEWAMGJQBKMLJ-SLRCPGGASA-N
InChI	InChI=1S/C28H45BrO10/c1-17-9-10-19-13-20(37-26-25(35-6)24(34-5)23(33-4)18(2)36-26)14-28(32,38-19)16-22(31)39-27(3,15-21(17)30)11-7-8-12-29/h7-8,11-12,17-21,23-26,30,32H,9-10,13-16H2,1-6H3/b11-7+,12-8-/t17-,18+,19+,20-,21-,23+,24-,25-,26+,27-,28+/m1/s1
SMILES	C[C@@H]1CC[C@H]2C[C@H](C[C@](O2)(CC(=O)O[C@](C[C@H]1O)(C)/C=C/C=C\Br)O)O[C@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)C)OC)OC)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Matthew, Susan; Salvador, Lilibeth A.; Schupp, Peter J.; Paul, Valerie J.; Luesch, Hendrik Cytotoxic halogenated macrolides and modified peptides from the apratoxin-producing marine cyanobacterium Lyngbya bouillonii from Guam Journal of Natural Products 2010 73 (9) 1544-1552.
DOI	10.1021/np1004032	PMID	20704304

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	Lyngbya	LPSN	28073

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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