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:27836 - dodecanal
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
dodecanal
ChEBI ID
CHEBI:27836
Definition
A long-chain fatty aldehyde that is dodecane in which two hydrogens attached to a terminal carbon are replaced by an oxo group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
abridge
Secondary ChEBI IDs
CHEBI:4679, CHEBI:23873, CHEBI:84068
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
Wikipedia
License
Read full article at Wikipedia
Formula
C12H24O
Net Charge
0
Average Mass
184.31840
Monoisotopic Mass
184.18272
InChI
InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h12H,2-11H2,1H3
InChIKey
HFJRKMMYBMWEAD-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCC=O
Metabolite of Species
Details
Coriandrum sativum
(NCBI:txid4047)
See:
PubMed
Persicaria minor
(NCBI:txid488003)
See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
dodecanal (
CHEBI:27836
)
has parent hydride
dodecane (
CHEBI:28817
)
dodecanal (
CHEBI:27836
)
has role
plant metabolite (
CHEBI:76924
)
dodecanal (
CHEBI:27836
)
is a
2,3-saturated fatty aldehyde (
CHEBI:84587
)
dodecanal (
CHEBI:27836
)
is a
long-chain fatty aldehyde (
CHEBI:17176
)
dodecanal (
CHEBI:27836
)
is a
medium-chain fatty aldehyde (
CHEBI:142621
)
IUPAC Name
lauraldehyde
Synonyms
Sources
dodecanal
UniProt
dodecanaldehyde
NIST Chemistry WebBook
dodecyl aldehyde
NIST Chemistry WebBook
lauric aldehyde
ChemIDplus
lauryl aldehyde
ChemIDplus
Laurylaldehyde
SUBMITTER
n-dodecanal
NIST Chemistry WebBook
n-dodecyl aldehyde
NIST Chemistry WebBook
n-dodecylic aldehyde
NIST Chemistry WebBook
n-lauraldehyde
NIST Chemistry WebBook
Manual Xrefs
Databases
C00030644
KNApSAcK
C02278
KEGG COMPOUND
CPD-7880
MetaCyc
Dodecanal
Wikipedia
HMDB0033933
HMDB
LMFA06000071
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
112-54-9
CAS Registry Number
ChemIDplus
1703917
Reaxys Registry Number
Reaxys
Citations
Types
Sources
25182942
PubMed citation
Europe PMC
25204054
PubMed citation
Europe PMC
25340465
PubMed citation
Europe PMC
25420073
PubMed citation
Europe PMC
25577087
PubMed citation
Europe PMC
25598627
PubMed citation
Europe PMC
Last Modified
04 March 2019