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Compounds

COMPOUND NPA004761

STRUCTURE

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PROPERTIES

NPAID	NPA004761
CLUSTER ID	46
NODE ID	11
NAME	7-Chloro-1-O-methyl-w-hydroxyemodin
FORMULA	C16H11ClO6
MOLECULAR WEIGHT (Da)	334.7110
ACCURATE MASS (Da)	334.0244
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Nephroma
ORIGIN SPECIES	laevigatum
InChIKey	LAWIYIBDGDHAKG-UHFFFAOYSA-N
InChI	InChI=1S/C16H11ClO6/c1-23-10-3-6(5-18)2-7-11(10)15(21)12-8(14(7)20)4-9(19)13(17)16(12)22/h2-4,18-19,22H,5H2,1H3
SMILES	COC1=C2C(=CC(=C1)CO)C(=O)C3=CC(=C(C(=C3C2=O)O)Cl)O

ORIGINAL ISOLATION REFERENCE

CITATION	Cohen, Peter A.; Towers, G. H. Neil Anthraquinones and Phenanthroperylenequinones from Nephroma laevigatum Journal of Natural Products 1995 58 (4) 520-526.
DOI	10.1021/np50118a006	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Lecanoromycetes	MycoBank	147547
Order	Peltigerales	MycoBank	388450
Family	Nephromataceae	MycoBank	48857
Genus	Nephroma	MycoBank	48858

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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