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:84274 - (
E
)-dodec-2-enoate
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
(
E
)-dodec-2-enoate
ChEBI ID
CHEBI:84274
ChEBI ASCII Name
(E)-dodec-2-enoate
Definition
An unsaturated fatty acid anion that is the conjugate base of trans-2-dodecenoic acid obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Nevila Nouspikel
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
C12H21O2
Net Charge
-1
Average Mass
197.294
Monoisotopic Mass
197.15470
InChI
InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h10-11H,2-9H2,1H3,(H,13,14)/p-1/b11-10+
InChIKey
PAWGRNGPMLVJQH-ZHACJKMWSA-M
SMILES
C(CCCCCCCC)/C=C/C(=O)[O-]
ChEBI Ontology
Outgoing
(
E
)-dodec-2-enoate (
CHEBI:84274
)
is a
medium-chain fatty acid anion (
CHEBI:59558
)
(
E
)-dodec-2-enoate (
CHEBI:84274
)
is a
unsaturated fatty acid anion (
CHEBI:2580
)
(
E
)-dodec-2-enoate (
CHEBI:84274
)
is conjugate base of
trans
-2-dodecenoic acid (
CHEBI:37162
)
Incoming
trans
-2-dodecenoic acid (
CHEBI:37162
)
is conjugate acid of
(
E
)-dodec-2-enoate (
CHEBI:84274
)
IUPAC Name
(2
E
)-dodec-2-enoate
Synonym
Source
(2
E
)-dodecenoate
UniProt
Citation
Type
Source
17524985
PubMed citation
SUBMITTER
Last Modified
26 October 2016