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Compounds

COMPOUND NPA011316

STRUCTURE

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PROPERTIES

NPAID	NPA011316
CLUSTER ID	4391
NODE ID	3229
NAME	JBIR-85
FORMULA	C22H20O10
MOLECULAR WEIGHT (Da)	444.3920
ACCURATE MASS (Da)	444.1056
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. RI-77
InChIKey	IUTSIXZLCRUCRS-AHIRLFQDSA-N
InChI	InChI=1S/C22H20O10/c1-7(23)8-4-11-9-6-21(8)15(19(28)22(9,31-3)20(29)32-11)17(26)13-10(24)5-12(30-2)16(25)14(13)18(21)27/h5,8-9,11,24-26H,4,6H2,1-3H3/t8-,9-,11+,21-,22-/m0/s1
SMILES	CC(=O)[C@@H]1C[C@@H]2[C@@H]3C[C@@]14C(=C(C5=C(C4=O)C(=C(C=C5O)OC)O)O)C(=O)[C@@]3(C(=O)O2)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Izumikawa, Miho; Satou, Ryutaro; Motohashi, Keiichiro; Nagai, Aya; Ohnishi, Yasuo; Takagi, Motoki; Shin-Ya, Kazuo Naphthoquinone-like polyketide isolated from Streptomyces sp. RI-77 and its predicted biosynthetic pathway Journal of Natural Products 2011 74 (12) 2588-2591.
DOI	10.1021/np200651e	PMID	22145663

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptomycetales	LPSN	85011
Family	Streptomycetaceae	LPSN	2062
Genus	Streptomyces	LPSN	1883

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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