Compound Summary
isocitric acid
Compound Information
isocitric acid
Compound Name: | isocitric acid |
Compound CID: | 1198 |
Synonyms: | isocitric acid isocitrate 320-77-4 1-Hydroxypropane-1,2,3-tricarboxylic acid 3-Carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid More... |
Iupac Name: | 1-hydroxypropane-1,2,3-tricarboxylic acid |
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 |
Canonical Smiles: | C(C(C(C(=O)O)O)C(=O)O)C(=O)O |
Isomeric Smiles: | C(C(C(C(=O)O)O)C(=O)O)C(=O)O |
Molecular Weight: | 192.12 |
Molecular Formula: | C6H8O7 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
isocitric acid
Molecular Weight: | 192.12 |
Molecular Formula: | C6H8O7 |
Hydrogen Bond Donor Count: | 4 |
Hydrogen Bond Acceptor Count: | 7 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 13 |
Complexity: | 233 |
Synonyms
isocitric acid
| isocitric acid | isocitric acid |
|---|---|
isocitric acid |
isocitrate |
320-77-4 |
1-Hydroxypropane-1,2,3-tricarboxylic acid |
3-Carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid |
DL-Isocitric acid |
I-CIT |
3-carboxy-2,3-dideoxypentaric acid |
UNII-9RW6G5D4MQ |
1-Hydroxytricarballylic acid |
9RW6G5D4MQ |
1-Hydroxy-1,2,3-propanetricarboxylic acid |
CHEBI:30887 |
D-isocitrate |
pentaric acid, 3-carboxy-2,3-dideoxy- |
1-Hydroxy-1,2,3-propanetricarboxylate |
EINECS 206-282-3 |
1-hydroxytricarballylate |
Isocitric acid (8CI) |
threo-d(s)-iso-citrate |
SCHEMBL8373 |
CHEMBL539669 |
BDBM92496 |
DTXSID60861871 |
3-carboxy-2,3-dideoxy-Pentarate |
NSC203797 |
3-carboxy-2,3-dideoxy-Pentaric acid |
AKOS006227850 |
NSC-203797 |
DB-005441 |
FT-0775163 |
C00311 |
Pentaric acid, 3-carboxy-2,3-dideoxy- (9CI) |
Q288927 |
3-Carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylate |
91BDE4FE-7872-4F5E-B191-62956199D37C |
Experimental Data
isocitric acid
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 2.000000000000000 | mM | 17.200000000000000 | 17.500000000000000 | 0.020000000000000 | NS | N2 | 30710163 | Inactive |
Experimental Data Visualization
isocitric acid
Statistics Data
isocitric acid
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0.020000000000000 | 1 | 1 |
Statistics Data Visualization
isocitric acid
