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Compounds

COMPOUND NPA002222

STRUCTURE

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PROPERTIES

NPAID	NPA002222
CLUSTER ID	1341
NODE ID	1130
NAME	Octalin
FORMULA	C12H20
MOLECULAR WEIGHT (Da)	164.2920
ACCURATE MASS (Da)	164.1565
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	avermitilis
InChIKey	HDVGBFCTHLFNEE-ASKATJPDSA-N
InChI	InChI=1S/C12H20/c1-10-6-5-9-12(2)8-4-3-7-11(10)12/h3,7,10-11H,4-6,8-9H2,1-2H3/t10-,11?,12+/m0/s1
SMILES	C[C@H]1CCC[C@@]2(C1C=CCC2)C

ORIGINAL ISOLATION REFERENCE

CITATION	Cane, David E; He, Xiaofei; Kobayashi, Seiji; Ōmura, Satoshi; Ikeda, Haruo Geosmin Biosynthesis in Streptomyces avermitilis. Molecular Cloning, Expression and Mechanistic Study of the Germacradienol/Geosmin Synthase Journal of Antibiotics 2006 59 (8) 471-479.
DOI	10.1038/ja.2006.66	PMID	17080683

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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