Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:66729 - 6-n-Pentyl-alpha-pyrone
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
6-n-Pentyl-alpha-pyrone
ChEBI ID
CHEBI:66729
Definition
A natural product found in
Myrothecium
and
Trichoderma koningii
.
Stars
This entity has been manually annotated by a third party.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
more structures >>
Molfile
Formula
C10H14O2
Net Charge
0
Average Mass
166.217
Monoisotopic Mass
166.09938
InChI
InChI=1S/C10H14O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h5,7-8H,2-4,6H2,1H3
InChIKey
MAUFTTLGOUBZNA-UHFFFAOYSA-N
SMILES
C1(C=CC=C(O1)CCCCC)=O
Metabolite of Species
Details
Myrothecium
(NCBI:txid5531)
See:
PubMed
Trichoderma koningii
(NCBI:txid97093)
See:
DOI
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
6-n-Pentyl-alpha-pyrone (
CHEBI:66729
)
has role
metabolite (
CHEBI:25212
)
6-n-Pentyl-alpha-pyrone (
CHEBI:66729
)
is a
2-pyranones (
CHEBI:75885
)
Synonyms
Sources
2H-Pyran-2-one, 6-pentyl-
ChEBI
5-Hydroxy-2,4-decadienoic acid delta-lactone
ChEBI
6-Amyl-2-pyrone
ChEBI
Manual Xrefs
Databases
0027593233
ChemIDplus
HMDB0031085
HMDB
View more database links
Citation
Type
Source
15802853
PubMed citation
Europe PMC
Last Modified
11 May 2016
General Comment
2014-10-17
Suggested Classification: ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:lactone(CHEBI:25000); ISA:organooxygen compound(CHEBI:36963);