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Compounds

COMPOUND NPA018666

STRUCTURE

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PROPERTIES

NPAID	NPA018666
CLUSTER ID	83
NODE ID	78
NAME	Epicoccin T
FORMULA	C18H22N2O6S2
MOLECULAR WEIGHT (Da)	426.5160
ACCURATE MASS (Da)	426.0919
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Epicoccum
ORIGIN SPECIES	nigrum
InChIKey	ZJUQZCAFDJFOTB-SFCFVZBVSA-N
InChI	InChI=1S/C18H22N2O6S2/c21-9-1-3-11(23)13-7(9)5-17-15(25)20-14-8(10(22)2-4-12(14)24)6-18(20,28-27-17)16(26)19(13)17/h7-9,11-14,21,23-24H,1-6H2/t7-,8-,9+,11+,12+,13+,14-,17-,18-/m1/s1
SMILES	C1C[C@@H]([C@@H]2[C@@H]([C@H]1O)C[C@]34N2C(=O)[C@@]5(C[C@H]6[C@@H](N5C3=O)[C@H](CCC6=O)O)SS4)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	Dothideomycetes	MycoBank	147541
Order	Pleosporales	MycoBank	92860
Family	Didymellaceae	MycoBank	683158
Genus	Epicoccum	MycoBank	104397

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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