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Compounds

COMPOUND NPA031433

STRUCTURE

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PROPERTIES

NPAID	NPA031433
CLUSTER ID	84
NODE ID	79
NAME	Desmethyl-5-hydroxynovobiocin
FORMULA	C30H34N2O12
MOLECULAR WEIGHT (Da)	614.6040
ACCURATE MASS (Da)	614.2112
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. RJA2961
InChIKey	JTTISVWBARQIRG-BOFKSZNZSA-N
InChI	InChI=1S/C30H34N2O12/c1-12(2)6-7-14-10-15(11-17(33)20(14)34)26(38)32-19-21(35)16-8-9-18(13(3)23(16)42-27(19)39)41-28-22(36)24(43-29(31)40)25(37)30(4,5)44-28/h6,8-11,22,24-25,28,33-37H,7H2,1-5H3,(H2,31,40)(H,32,38)/t22-,24+,25-,28-/m1/s1
SMILES	CC(C)=CCC1=C(O)C(O)=CC(C(=O)NC2=C(O)C3=C(OC2=O)C(C)=C(O[C@@H]2OC(C)(C)[C@H](O)[C@@H](OC(N)=O)[C@H]2O)C=C3)=C1

ORIGINAL ISOLATION REFERENCE

CITATION	Doralyn S. Dalisay,David E. Williams,Xiao Ling Wang,Ryan Centko,Jessie Chen,Raymond J. Andersen Marine sediment-derived Streptomyces bacteria from British Columbia, Canada are a promising microbiota resource for the discovery of antimicrobial natural products. PLoS One 2013 8 (10) e77078.
DOI	10.1371/journal.pone.0077078	PMID	24130838

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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