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Compounds

COMPOUND NPA002754

STRUCTURE

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PROPERTIES

NPAID	NPA002754
CLUSTER ID	1606
NODE ID	1316
NAME	Caprolactin A
FORMULA	C15H28N2O2
MOLECULAR WEIGHT (Da)	268.4010
ACCURATE MASS (Da)	268.2151
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Unknown-bacterium
ORIGIN SPECIES	sp.
InChIKey	UYRISSPQCFBDAQ-ZDUSSCGKSA-N
InChI	InChI=1S/C15H28N2O2/c1-12(2)8-4-3-5-10-14(18)17-13-9-6-7-11-16-15(13)19/h12-13H,3-11H2,1-2H3,(H,16,19)(H,17,18)/t13-/m0/s1
SMILES	CC(C)CCCCCC(=O)N[C@H]1CCCCNC1=O

ORIGINAL ISOLATION REFERENCE

CITATION	Davidson, Bradley S.; Schumacher, Robert W. Isolation and synthesis of caprolactins A and B, new caprolactams from a marine bacterium Tetrahedron 1993 49 (30) 6569-6574.
DOI	10.1016/s0040-4020(01)81825-1	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Genus	Unknown-bacterium	LPSN	-

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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