Natural Products Atlas | Compounds

The Natural Products Atlas

Login

Compounds

COMPOUND NPA027333

STRUCTURE

Image structure

EXPORT OPTIONS	PNG JSON SDF
PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA027333
CLUSTER ID	8256
NODE ID	5609
NAME	Kimbelactone A
FORMULA	C19H25ClO3
MOLECULAR WEIGHT (Da)	336.8590
ACCURATE MASS (Da)	336.1492
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Symploca
ORIGIN SPECIES	sp.
InChIKey	FFQPDMLQLMDNCB-OOYZWKPBSA-N
InChI	InChI=1S/C19H25ClO3/c1-15(10-11-16(2)14-20)8-6-4-5-7-9-17-12-18(22-3)13-19(21)23-17/h4-6,8,10-11,13-15,17H,7,9,12H2,1-3H3/b5-4+,8-6-,11-10+,16-14+
SMILES	COC1=CC(=O)OC(CC/C=C/C=C\C(C)/C=C/C(C)=C/Cl)C1

ORIGINAL ISOLATION REFERENCE

CITATION	Nunnery JK; Engene N; Byrum T; Cao Z; Jabba SV; Pereira AR; Matainaho T; Murray TF; Gerwick WH Biosynthetically intriguing chlorinated lipophilic metabolites from geographically distant tropical marine cyanobacteria. Journal of Organic Chemistry 2012 77 (9) 4198-4208.
DOI	10.1021/jo300160e	PMID	22489775

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Oscillatoriales	LPSN	1150
Family	Microcoleaceae	LPSN	1892252
Genus	Symploca	LPSN	105591

CLASSYFIRE

Show		Hide
DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

Show		Hide
SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

If you encounter an issue on the website, please submit a bug report, feature request, or general issue through the issue tracker on GitHub.

Made with ♥ using Python

DB Version: 2024_09

Website Version: 3.0.2

Creative Commons License

The Natural Products Atlas is licensed under a Creative Commons Attribution-Noncommercial 4.0 International License.

Back to top of page