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:17205 - 2-oxohept-3-enedioate
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
2-oxohept-3-enedioate
ChEBI ID
CHEBI:17205
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:11639, CHEBI:19750
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
C7H6O5
Net Charge
-2
Average Mass
170.11954
Monoisotopic Mass
170.02262
InChI
InChI=1S/C7H8O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1,3H,2,4H2,(H,9,10)(H,11,12)/p-2
InChIKey
HYVSZVZMTYIHKF-UHFFFAOYSA-L
SMILES
[H]C(CCC([O-])=O)=C([H])C(=O)C([O-])=O
ChEBI Ontology
Outgoing
2-oxohept-3-enedioate (
CHEBI:17205
)
is a
heptenedioate (
CHEBI:24521
)
2-oxohept-3-enedioate (
CHEBI:17205
)
is conjugate base of
2-oxohept-3-enedioic acid (
CHEBI:48061
)
Incoming
2-oxohept-3-enedioic acid (
CHEBI:48061
)
is conjugate acid of
2-oxohept-3-enedioate (
CHEBI:17205
)
IUPAC Name
2-oxohept-3-enedioate
Synonym
Source
2-oxohept-3-ene-1,7-dioate
ChEBI
Manual Xrefs
Databases
C03063
KEGG COMPOUND
c0309
UM-BBD
View more database links
Last Modified
17 August 2015