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Compounds

COMPOUND NPA004635

STRUCTURE

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PROPERTIES

NPAID	NPA004635
CLUSTER ID	2382
NODE ID	1183
NAME	2a,8a-epoxy-epi-deacetylgriseusin B
FORMULA	C20H20O10
MOLECULAR WEIGHT (Da)	420.3700
ACCURATE MASS (Da)	420.1056
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Nocardiopsis
ORIGIN SPECIES	sp.
InChIKey	ZRTFDOHHKNWDGO-UAJALOPQSA-N
InChI	InChI=1S/C20H20O10/c1-8-5-12(22)16(26)20(28-8)19-17(27)14-10(3-2-4-11(14)21)15(25)18(19,30-19)7-9(29-20)6-13(23)24/h2-4,8-9,12,16,21-22,26H,5-7H2,1H3,(H,23,24)/t8-,9-,12+,16-,18+,19-,20+/m1/s1
SMILES	C[C@@H]1C[C@@H]([C@H]([C@@]2(O1)[C@@]34C(=O)C5=C(C=CC=C5O)C(=O)[C@@]3(O4)C[C@H](O2)CC(=O)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	He, Jian; Roemer, Ernst; Lange, Corinna; Huang, Xueshi; Maier, Armin; Kelter, Gerhard; Jiang, Yi; Xu, Li-Hua; Menzel, Klaus-Dieter; Grabley, Susanne; Fiebig, Heinz-Herbert; Jiang, Cheng-Ling; Sattler, Isabel Structure, derivatization, and antitumor activity of new griseusins from Nocardiopsis sp Journal of Medicinal Chemistry 2007 50 (21) 5168-5175.
DOI	10.1021/jm070170n	PMID	17877337

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptosporangiales	LPSN	85012
Family	Nocardiopsaceae	LPSN	83676
Genus	Nocardiopsis	LPSN	2013

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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