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Compounds

COMPOUND NPA025847

STRUCTURE

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PROPERTIES

NPAID	NPA025847
CLUSTER ID	46
NODE ID	11
NAME	(10R,10′R)-wentibianthrone C
FORMULA	C33H28O8
MOLECULAR WEIGHT (Da)	552.5790
ACCURATE MASS (Da)	552.1784
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	wentii
InChIKey	BWKZQMHHIFWJID-KAYWLYCHSA-N
InChI	InChI=1S/C33H28O8/c1-14-6-18-26(20-10-16(34)11-24(40-4)30(20)32(37)28(18)22(35)8-14)27-19-7-15(2)9-23(36)29(19)33(38)31-21(27)12-17(39-3)13-25(31)41-5/h6-13,26-27,34-36H,1-5H3/t26-,27-/m1/s1
SMILES	COC1=CC(OC)=C2C(=O)C3=C(O)C=C(C)C=C3[C@@H]([C@@H]3C4=CC(C)=CC(O)=C4C(=O)C4=C(OC)C=C(O)C=C43)C2=C1

ORIGINAL ISOLATION REFERENCE

CITATION	Form, Imke C.; Bonus, Michele; Gohlke, Holger; Lin, Wenhan; Daletos, Georgios; Proksch, Peter Xanthone, benzophenone and bianthrone derivatives from the hypersaline lake-derived fungus Aspergillus wentii Bioorganic and Medicinal Chemistry 2019 27 (20) None.
DOI	10.1016/j.bmc.2019.07.021	PMID	31466836

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	Aspergillus	MycoBank	5052

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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