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Compounds

COMPOUND NPA018847

STRUCTURE

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PROPERTIES

NPAID	NPA018847
CLUSTER ID	736
NODE ID	642
NAME	Cylindrocyclophane C2
FORMULA	C36H54Cl2O5
MOLECULAR WEIGHT (Da)	637.7290
ACCURATE MASS (Da)	636.3348
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Nostoc
ORIGIN SPECIES	sp.
InChIKey	NEHSJAVXGQMVJK-JSTSWHIPSA-N
InChI	InChI=1S/C36H54Cl2O5/c1-4-5-13-26-14-8-6-11-23(2)18-25-19-29(39)34(30(40)20-25)27(16-10-17-33(37)38)15-9-7-12-24(3)36(43)28-21-31(41)35(26)32(42)22-28/h19-24,26-27,33,36,39-43H,4-18H2,1-3H3/t23-,24-,26-,27+,36+/m0/s1
SMILES	CCCC[C@H]1CCCC[C@@H](CC2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O)C)CCCC(Cl)Cl)C(=C2)O)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Chlipala, George E.; Sturdy, Megan; Krunic, Aleksej; Lantvit, Daniel D.; Shen, Qi; Porter, Kyle; Swanson, Steven M.; Orjala, Jimmy Cylindrocyclophanes with proteasome inhibitory activity from the cyanobacterium Nostoc sp Journal of Natural Products 2010 73 (9) 1529-1537.
DOI	10.1021/np100352e	PMID	20825206

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Nostocales	LPSN	1161
Family	Nostocaceae	LPSN	1162
Genus	Nostoc	LPSN	1177

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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