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Compounds

COMPOUND NPA029291

STRUCTURE

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PROPERTIES

NPAID	NPA029291
CLUSTER ID	8638
NODE ID	5841
NAME	Chlorosphaerolactylate D
FORMULA	C15H25Cl3O4
MOLECULAR WEIGHT (Da)	375.7200
ACCURATE MASS (Da)	374.0818
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Sphaerospermopsis
ORIGIN SPECIES	sp. LEGE 00249
InChIKey	ISBIDCLRYLGPPC-UHFFFAOYSA-N
InChI	InChI=1S/C15H25Cl3O4/c1-11(15(20)21)22-14(19)10-6-5-8-12(16)7-3-2-4-9-13(17)18/h11-13H,2-10H2,1H3,(H,20,21)
SMILES	CC(OC(=O)CCCCC(Cl)CCCCCC(Cl)Cl)C(=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Gutiérrez-Del-Río, Ignacio; de Fraissinette, Nelly Brugerolle; Castelo-Branco, Raquel; Oliveira, Flavio; Morais, Joaõ; Redondo-Blanco, Saul; Villar, Claudio J.; JoséIglesias, María; Soengas, Raquel; Cepas, Virginio; Cubillos, Yuly López; Sampietro, Giacomo; Rodolfi, Liliana; Lombo, Felipe; Soto Gonzaléz, Sara M.; Ortiz, Fernando López; Vasconcelos, Vitor; Reis, Mariana A. Chlorosphaerolactylates A−D: Natural lactylates of chlorinated fatty acids isolated from the cyanobacterium sphaerospermopsis sp. Lege 00249 Journal of Natural Products 2020 83 (6) 1885-1890.
DOI	10.1021/acs.jnatprod.0c00072	PMID	32479093

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Nostocales	LPSN	1161
Family	Aphanizomenonaceae	LPSN	1892259
Genus	Sphaerospermopsis	LPSN	752201

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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