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Compounds

COMPOUND NPA020379

STRUCTURE

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PROPERTIES

NPAID	NPA020379
CLUSTER ID	1531
NODE ID	1258
NAME	ML-449
FORMULA	C29H39NO3
MOLECULAR WEIGHT (Da)	449.6350
ACCURATE MASS (Da)	449.2930
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp.
InChIKey	QUZNSWBEDCHESP-KLYFDHOZSA-N
InChI	InChI=1S/C29H39NO3/c1-4-5-6-7-8-9-19-26-20-13-10-16-24(2)17-11-14-21-27(31)28(32)23-25(3)18-12-15-22-29(33)30-26/h6-18,21-23,26-28,31-32H,4-5,19-20H2,1-3H3,(H,30,33)/b7-6+,9-8+,13-10+,17-11+,18-12+,21-14+,22-15+,24-16+,25-23+
SMILES	CCC/C=C/C=C/CC1C/C=C/C=C(/C=C/C=C/C(C(/C=C(/C=C/C=C/C(=O)N1)\C)O)O)\C

ORIGINAL ISOLATION REFERENCE

CITATION	Jørgensen H; Degnes KF; Dikiy A; Fjaervik E; Klinkenberg G; Zotchev SB Insights into the evolution of macrolactam biosynthesis through cloning and comparative analysis of the biosynthetic gene cluster for a novel macrocyclic lactam, ML-449. Applied and Environmental Microbiology 2010 76 (1) 283-293.
DOI	10.1128/AEM.00744-09	PMID	19854930

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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