Natural Products Atlas | Compounds

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Compounds

ID	Spectrum Quality	Annotated Name
CCMSLIB00004701465	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701466	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701467	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701468	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701469	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701470	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701471	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701472	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701473	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701474	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701475	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701476	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701477	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701478	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid
CCMSLIB00004701479	Bronze	6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carboxylic&acid

COMPOUND NPA017335

STRUCTURE

Image structure

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA017335
CLUSTER ID	46
NODE ID	11
NAME	2-chloroemodic acid
FORMULA	C15H7ClO7
MOLECULAR WEIGHT (Da)	334.6670
ACCURATE MASS (Da)	333.9880
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	restrictum
InChIKey	JGHTWRZCNLXYPF-UHFFFAOYSA-N
InChI	InChI=1S/C15H7ClO7/c16-11-8(18)3-6-10(14(11)21)13(20)9-5(12(6)19)1-4(15(22)23)2-7(9)17/h1-3,17-18,21H,(H,22,23)
SMILES	C1=C(C=C2C(=C1O)C(=O)C3=C(C(=C(C=C3C2=O)O)Cl)O)C(=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Figueroa, Mario; Jarmusch, Alan K.; Raja, Huzefa A.; El-Elimat, Tamam; Kavanaugh, Jeffrey S.; Horswill, Alexander R.; Cooks, R. Graham; Cech, Nadja B.; Oberlies, Nicholas H. Polyhydroxyanthraquinones as quorum sensing inhibitors from the guttates of Penicillium restrictum and their analysis by desorption electrospray ionization mass spectrometry Journal of Natural Products 2014 77 (6) 1351-1358.
DOI	10.1021/np5000704	PMID	24911880

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Penicillium	MycoBank	5073

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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