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Compounds

COMPOUND NPA017262

STRUCTURE

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PROPERTIES

NPAID	NPA017262
CLUSTER ID	83
NODE ID	78
NAME	Ent-epicoccin G (2)
FORMULA	C20H26N2O6S2
MOLECULAR WEIGHT (Da)	454.5700
ACCURATE MASS (Da)	454.1232
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Exophiala
ORIGIN SPECIES	nigrum LJJ028
InChIKey	FZVZQZDYZWKKHU-HGGCUFLRSA-N
InChI	InChI=1S/C20H26N2O6S2/c1-29-19-7-9-11(23)3-5-13(25)15(9)21(19)18(28)20(30-2)8-10-12(24)4-6-14(26)16(10)22(20)17(19)27/h9-10,13-16,25-26H,3-8H2,1-2H3/t9-,10-,13-,14-,15-,16-,19+,20+/m1/s1
SMILES	CS[C@]12C[C@H]3[C@@H](N1C(=O)[C@]4(C[C@H]5[C@@H](N4C2=O)[C@@H](CCC5=O)O)SC)[C@@H](CCC3=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Wang, Jia-Ming; Ding, Guang-Zhi; Fang, Lei; Dai, Jun-Gui; Yu, Shi-Shan; Wang, Ying-Hong; Chen, Xiao-Guang; Ma, Shuang-Gang; Qu, Jing; Xu, Song; Du, Dan Thiodiketopiperazines Produced by the Endophytic Fungus Epicoccum nigrum Journal of Natural Products 2010 73 (7) 1240-1249.
DOI	10.1021/np1000895	PMID	20550196

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Chaetothyriales	MycoBank	34395
Family	Herpotrichiellaceae	MycoBank	43219
Genus	Exophiala	MycoBank	5583

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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