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Compounds

COMPOUND NPA027279

STRUCTURE

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PROPERTIES

NPAID	NPA027279
CLUSTER ID	7073
NODE ID	4870
NAME	Trichophycin E
FORMULA	C20H31BrCl2O2
MOLECULAR WEIGHT (Da)	454.2760
ACCURATE MASS (Da)	452.0884
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Trichodesmium
ORIGIN SPECIES	sp.
InChIKey	ZCYDJOFQQAFCJI-NZIPSRDRSA-N
InChI	InChI=1S/C20H31BrCl2O2/c1-16(13-17(2)20(25)8-6-12-22)9-10-19(24)14-18(15-23)7-4-3-5-11-21/h6,12,15-17,19-20,24-25H,3-4,7-10,13-14H2,1-2H3/b12-6+,18-15+/t16-,17-,19-,20+/m1/s1
SMILES	C[C@H](CC[C@@H](O)C/C(=C/Cl)CCCC#CBr)C[C@@H](C)[C@@H](O)C/C=C/Cl

ORIGINAL ISOLATION REFERENCE

CITATION	Bertin MJ; Saurí J; Liu Y; Via CW; Roduit AF; Williamson RT Trichophycins B-F, Chlorovinylidene-Containing Polyketides Isolated from a Cyanobacterial Bloom. Journal of Organic Chemistry 2018 83 (21) 13256-13266.
DOI	10.1021/acs.joc.8b02070	PMID	30280904

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Oscillatoriales	LPSN	1150
Family	Microcoleaceae	LPSN	1892252
Genus	Trichodesmium	LPSN	1205

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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