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:73752 - 2-hydroxyheptanoic acid
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
2-hydroxyheptanoic acid
ChEBI ID
CHEBI:73752
Definition
A monohydroxy fatty acid that is heptanoic acid with a hydroxy group substituted at position C-2.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C7H14O3
Net Charge
0
Average Mass
146.18430
Monoisotopic Mass
146.09429
InChI
InChI=1S/C7H14O3/c1-2-3-4-5-6(8)7(9)10/h6,8H,2-5H2,1H3,(H,9,10)
InChIKey
RGMMREBHCYXQMA-UHFFFAOYSA-N
SMILES
CCCCCC(O)C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
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
2-hydroxyheptanoic acid (
CHEBI:73752
)
has functional parent
heptanoic acid (
CHEBI:45571
)
2-hydroxyheptanoic acid (
CHEBI:73752
)
has role
metabolite (
CHEBI:25212
)
2-hydroxyheptanoic acid (
CHEBI:73752
)
is a
2-hydroxy fatty acid (
CHEBI:10283
)
IUPAC Name
2-hydroxyheptanoic acid
Synonym
Source
2-hydroxy enanthoic acid
LIPID MAPS
Manual Xref
Database
LMFA01050016
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1722019
Reaxys Registry Number
Reaxys
636-69-1
CAS Registry Number
ChemIDplus
Citation
Type
Source
20120041
PubMed citation
Europe PMC
Last Modified
12 September 2013