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Compounds

COMPOUND NPA006146

STRUCTURE

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PROPERTIES

NPAID	NPA006146
CLUSTER ID	2920
NODE ID	2249
NAME	Halawanone A
FORMULA	C23H22O9
MOLECULAR WEIGHT (Da)	442.4200
ACCURATE MASS (Da)	442.1264
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp.
InChIKey	VXCYZJAOJKUJMO-RBTFZBJXSA-N
InChI	InChI=1S/C23H22O9/c1-3-14-18-11(23-16(31-14)7-17(26)32-23)4-9-12(24)5-10(21(28)19(9)22(18)29)15-6-13(25)20(27)8(2)30-15/h4-5,8,13-16,23,25,29H,3,6-7H2,1-2H3/t8-,13-,14-,15-,16-,23-/m1/s1
SMILES	CC[C@@H]1C2=C(C=C3C(=O)C=C(C(=O)C3=C2O)[C@H]4C[C@H](C(=O)[C@H](O4)C)O)[C@@H]5[C@H](O1)CC(=O)O5

ORIGINAL ISOLATION REFERENCE

CITATION	Ford, Paul W.; Gadepalli, Madhavi; Davidson, Bradley S. Halawanones A-D, New Polycyclic Quinones from a Marine-Derived Streptomycete Journal of Natural Products 1998 61 (10) 1232-1236.
DOI	10.1021/np980126y	PMID	9784158

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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