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Compounds

COMPOUND NPA017604

STRUCTURE

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PROPERTIES

NPAID	NPA017604
CLUSTER ID	5893
NODE ID	4141
NAME	PM181110
FORMULA	C18H30N2O5S2
MOLECULAR WEIGHT (Da)	418.5810
ACCURATE MASS (Da)	418.1596
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phomopsis
ORIGIN SPECIES	glabrae
InChIKey	MVEXFNFRQDFJIE-UHFFFAOYSA-N
InChI	InChI=1S/C18H30N2O5S2/c1-2-6-13-8-5-3-4-7-12(21)9-16(22)19-14-10-26-27-11-15(18(24)25-13)20-17(14)23/h12-15,21H,2-11H2,1H3,(H,19,22)(H,20,23)
SMILES	CCCC1CCCCCC(CC(=O)NC2CSSCC(C(=O)O1)NC2=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Verekar, Shilpa Amit; Mishra, Prabhu Dutt; Sreekumar, Eyyammadichiyil Sankaranarayanan; Deshmukh, Sunil Kumar; Fiebig, Heinz-Herbert; Kelter, Gerhard; Maier, Armin Anticancer activity of new depsipeptide compound isolated from an endophytic fungus Journal of Antibiotics 2014 67 (10) 697-701.
DOI	10.1038/ja.2014.58	PMID	24824817

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Genus	Phomopsis	MycoBank	34399

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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