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Compounds

COMPOUND NPA004945

STRUCTURE

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PROPERTIES

NPAID	NPA004945
CLUSTER ID	2491
NODE ID	1955
NAME	Hygrocin A
FORMULA	C28H31NO8
MOLECULAR WEIGHT (Da)	509.5550
ACCURATE MASS (Da)	509.2050
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	hygroscopicus
InChIKey	ZLKHATAJGWAFJX-ZIOKALIGSA-N
InChI	InChI=1S/C28H31NO8/c1-5-17-7-9-20(30)16(4)37-28(36)14(2)6-11-23(33)29-19-13-22(32)24-18(27(19)35)12-15(3)26(34)25(24)21(31)10-8-17/h6-7,9,12-13,16-17,20,30,34H,5,8,10-11H2,1-4H3,(H,29,33)/b9-7?,14-6+/t16-,17?,20-/m0/s1
SMILES	CCC1CCC(=O)C2=C3C(=CC(=C2O)C)C(=O)C(=CC3=O)NC(=O)C/C=C(/C(=O)O[C@H]([C@H](C=C1)O)C)\C

ORIGINAL ISOLATION REFERENCE

CITATION	Cai, Ping; Kong, Fangming; Ruppen, Mark E.; Glasier, Greg; Carter, Guy T. Hygrocins A and B, naphthoquinone macrolides from Streptomyces hygroscopicus Journal of Natural Products 2005 68 (12) 1736-1742.
DOI	10.1021/np050272l	PMID	16378365

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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