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Compounds

COMPOUND NPA024399

STRUCTURE

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PROPERTIES

NPAID	NPA024399
CLUSTER ID	7460
NODE ID	2759
NAME	Toblerol H
FORMULA	C12H22O4
MOLECULAR WEIGHT (Da)	230.3040
ACCURATE MASS (Da)	230.1518
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Methylobacterium
ORIGIN SPECIES	extorquens AM1
InChIKey	UWAPUEALJOJXHQ-CDHYUEMISA-N
InChI	InChI=1S/C12H22O4/c1-2-3-8-6-11(15)12(16-8)10(14)5-7-4-9(7)13/h7-15H,2-6H2,1H3/t7-,8+,9+,10?,11+,12-/m0/s1
SMILES	CCC[C@@H]1C[C@H]([C@@H](O1)C(C[C@@H]2C[C@H]2O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Ueoka, Reiko; Bortfeld-Miller, Miriam; Morinaka, Brandon I.; Vorholt, Julia A.; Piel, Jörn Toblerols: Cyclopropanol-Containing Polyketide Modulators of Antibiosis in Methylobacteria Angewandte Chemie International Edition 2018 57 (4) 977-981.
DOI	10.1002/anie.201709056	PMID	29112783

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Proteobacteria	LPSN	1224
Class	Alphaproteobacteria	LPSN	28211
Order	Rhizobiales	LPSN	-
Family	Methylobacteriaceae	LPSN	119045
Genus	Methylobacterium	LPSN	407

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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