Natural Products Atlas | Compounds

The Natural Products Atlas

Login

Compounds

COMPOUND NPA028053

STRUCTURE

Image structure

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

EXTERNAL LINKS

PROPERTIES

NPAID	NPA028053
CLUSTER ID	118
NODE ID	112
NAME	Isobutyl pentanoate
FORMULA	C9H18O2
MOLECULAR WEIGHT (Da)	158.2410
ACCURATE MASS (Da)	158.1307
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	clavatus NRRL 1
InChIKey	ADNADZOSMJDVIS-UHFFFAOYSA-N
InChI	InChI=1S/C9H18O2/c1-4-5-6-9(10)11-7-8(2)3/h8H,4-7H2,1-3H3
SMILES	CCCCC(=O)OCC(C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Brock, Nelson L.; Celik, Ersin; Dickschat, Jeroen S. Volatiles from three genome sequenced fungi from the genus Aspergillus Beilstein Journal of Organic Chemistry 2018 14 900-910.
DOI	10.3762/BJOC.14.77	PMID	29765471

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Aspergillus	MycoBank	5052

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