CHEBI:30887 - isocitric acid

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ChEBI Name isocitric acid
ChEBI ID CHEBI:30887
Definition A tricarboxylic acid that is propan-1-ol with a hydrogen at each of the 3 carbon positions substituted with a carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:5998, CHEBI:24886
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Formula C6H8O7
Net Charge 0
Average Mass 192.12352
Monoisotopic Mass 192.027
InChI InChI=1S/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)
InChIKey ODBLHEXUDAPZAU-UHFFFAOYSA-N
SMILES OC(C(CC(O)=O)C(O)=O)C(O)=O
Metabolite of Species Details
Chlamydomonas reinhardtii (NCBI:3055) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): fundamental metabolite
Any metabolite produced by all living cells.
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ChEBI Ontology
Outgoing isocitric acid (CHEBI:30887) has role fundamental metabolite (CHEBI:78675)
isocitric acid (CHEBI:30887) is a tricarboxylic acid (CHEBI:27093)
isocitric acid (CHEBI:30887) is conjugate acid of isocitrate(1−) (CHEBI:36454)
Incoming 2-caffeoylisocitric acid (CHEBI:16166) has functional parent isocitric acid (CHEBI:30887)
methylisocitric acid (CHEBI:25311) has functional parent isocitric acid (CHEBI:30887)
D-erythro-isocitric acid (CHEBI:160) is a isocitric acid (CHEBI:30887)
D-threo-isocitric acid (CHEBI:151) is a isocitric acid (CHEBI:30887)
L-erythro-isocitric acid (CHEBI:43291) is a isocitric acid (CHEBI:30887)
L-threo-isocitric acid (CHEBI:30889) is a isocitric acid (CHEBI:30887)
isocitrate(1−) (CHEBI:36454) is conjugate base of isocitric acid (CHEBI:30887)
IUPAC Names
1-hydroxypropane-1,2,3-tricarboxylic acid
3-carboxy-2,3-dideoxypentaric acid
Synonyms Sources
1-Hydroxypropane-1,2,3-tricarboxylic acid KEGG COMPOUND
1-Hydroxytricarballylic acid KEGG COMPOUND
Isocitric acid KEGG COMPOUND
Database Links Databases
C00001188 KNApSAcK
C00311 KEGG COMPOUND
DB01727 DrugBank
ECMDB04088 ECMDB
HMDB00193 HMDB
Isocitrate MetaCyc
Isocitric_acid Wikipedia
YMDB00026 YMDB
View more database links
Registry Numbers Types Sources
1727945 Reaxys Registry Number Reaxys
1727945 Beilstein Registry Number Beilstein
320-77-4 CAS Registry Number KEGG COMPOUND
320-77-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
17439666 PubMed citation Europe PMC
23989918 PubMed citation Europe PMC
24702026 PubMed citation Europe PMC
Last Modified
23 October 2015