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Compounds

COMPOUND NPA033159

STRUCTURE

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PROPERTIES

NPAID	NPA033159
CLUSTER ID	812
NODE ID	705
NAME	Secimide
FORMULA	C16H23NO6
MOLECULAR WEIGHT (Da)	325.3610
ACCURATE MASS (Da)	325.1525
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Pseudomonas
ORIGIN SPECIES	syringae B728a
InChIKey	CUHWACVSFBFFSP-AYTXJLRPSA-N
InChI	InChI=1S/C16H23NO6/c1-9(4-10(2)16(22)23-3)13(19)8-12(18)5-11-6-14(20)17-15(21)7-11/h4,9,11-12,18H,5-8H2,1-3H3,(H,17,20,21)/b10-4+/t9?,12-/m1/s1
SMILES	COC(=O)/C(C)=C/C(C)C(=O)C[C@H](O)CC1CC(=O)NC(=O)C1

ORIGINAL ISOLATION REFERENCE

CITATION	Helfrich, Eric J. N.; Ueoka, Reiko; Chevrette, Marc G.; Hemmerling, Franziska; Lu, Xiaowen; Leopold-Messer, Stefan; Minas, Hannah A.; Burch, Adrien Y.; Lindow, Steven E.; Piel, Jörn; Medema, Marnix H. Evolution of combinatorial diversity in trans-acyltransferase polyketide synthase assembly lines across bacteria Nature Communications 2021 12 (1) None.
DOI	10.1038/s41467-021-21163-x	PMID	33658492

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Proteobacteria	LPSN	1224
Class	Gammaproteobacteria	LPSN	1236
Order	Pseudomonadales	LPSN	72274
Family	Pseudomonadaceae	LPSN	135621
Genus	Pseudomonas	LPSN	286

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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