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Compounds

COMPOUND NPA017160

STRUCTURE

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PROPERTIES

NPAID	NPA017160
CLUSTER ID	2020
NODE ID	1620
NAME	Epoxyroussoeone
FORMULA	C15H14O7
MOLECULAR WEIGHT (Da)	306.2700
ACCURATE MASS (Da)	306.0740
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Roussoella
ORIGIN SPECIES	japanensis KT1651
InChIKey	MQQQPSKYLUIILH-YJNKXOJESA-N
InChI	InChI=1S/C15H14O7/c1-6-3-10(17)14-13(19)11-8(4-7(20-2)5-9(11)16)12(18)15(14,21-6)22-14/h3-5,12-13,16,18-19H,1-2H3/t12-,13+,14+,15-/m0/s1
SMILES	CC1=CC(=O)[C@@]23[C@@H](C4=C(C=C(C=C4[C@@H]([C@]2(O1)O3)O)OC)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Honmura, Yuna; Takekawa, Hiroto; Tanaka, Kazuaki; Maeda, Hayato; Nehira, Tatsuo; Hehre, Warren; Hashimoto, Masaru Computation-Assisted Structural Elucidation of Epoxyroussoeone and Epoxyroussoedione Isolated from Roussoella japanensis KT1651 Journal of Natural Products 2015 78 (7) 1505-1510.
DOI	10.1021/np500924n	PMID	26110600

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Dothideomycetes	MycoBank	147541
Order	Pleosporales	MycoBank	92860
Family	Thyridariaceae	MycoBank	1540118
Genus	Roussoella	MycoBank	63193

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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