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:89876 - 2,3-Methylenesuccinic acid
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
2,3-Methylenesuccinic acid
ChEBI ID
CHEBI:89876
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
Formula
C6H6O4
Net Charge
0
Average Mass
142.110
Monoisotopic Mass
142.02661
InChI
InChI=1S/C6H6O4/c1-3(5(7)8)4(2)6(9)10/h1-2H2,(H,7,8)(H,9,10)
InChIKey
PQGVRLYVSSROJJ-UHFFFAOYSA-N
SMILES
C=C(C(=C)C(=O)O)C(=O)O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2,3-Methylenesuccinic acid (
CHEBI:89876
)
is a
dicarboxylic acid (
CHEBI:35692
)
Synonym
Source
dimethylidenebutanedioic acid
HMDB
Manual Xref
Database
HMDB0059762
HMDB
View more database links
Citation
Type
Source
2338430
PubMed citation
Europe PMC