Small Molecule isocitrate

URN urn:agi-cas:320-77-4
Connectivity 31
Name isocitrate

Pathway Tricarboxylic acid cycle
citrate cycle pathway
citric acid cycle pathway

IUPAC Name 1-hydroxypropane-1,2,3-tricarboxylic acid
trisodium 1-hydroxypropane-1,2,3-tricarboxylate

InChIKey ODBLHEXUDAPZAU-UHFFFAOYSA-N
HWMVXEKEEAIYGB-UHFFFAOYSA-K

Rotatable Bond Count 5
2

MedScan ID 1254317

ChEBI ID 151
30887

Molecular Weight 192.123520
258.069010
192.123520
258.069010

CAS ID 320-77-4
1637-73-6

KEGG ID C00451
C00311

Alias (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid
1-hydroxypropane-1,2,3-tricarboxylic acid
1-hydroxytricarballylic acid
3-Carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid
3-carboxy-2,3-dideoxy-L-threo-pentaric acid
D-isocitrate
DL-Isocitric acid
D-threo-Isocitric acid
EINECS 206-282-3
EINECS 216-668-3
isocitrate
isocitric acid
isocitric acid, (11)C-labeled
isocitric acid, calcium salt
isocitric acid, disodium salt
isocitric acid, potassium salt
isocitric acid, sodium salt
isocitric acid, trisodium salt
Trisodium hydrogen 3-carboxylato-2,3-dideoxy-1-hydroxypropane-1,2,3-tricarboxylate
3-carboxy-2,3-dideoxy-Pentarate
3-carboxy-2,3-dideoxy-Pentaric acid
threo-d(s)-iso-citrate
1-Hydroxy-1,2,3-propanetricarboxylate
1-Hydroxy-1,2,3-propanetricarboxylic acid
1-Hydroxypropane-1,2,3-tricarboxylate
1-Hydroxytricarballylate
(+)-threo-isocitrate
(+)-threo-isocitric acid
(1R,2S)-1-Hydroxypropane-1,2,3-tricarboxylate
D-threo-isocitrate
DS-threo-isocitrate
DS-threo-isocitric acid
Threo-DS(+)-isocitrate
Threo-DS(+)-isocitric acid
Threo-d-(+)-isocitrate
Threo-d-(+)-isocitric acid
Threo-isocitrate
(1s,2s)-1-hydroxypropane-1,2,3-tricarboxylate
threo-
1637-73-6
320-77-4

PubChem SID 668200
746458

PubChem CID 1198
168942

XLogP -1.800000

Molecular Formula C6H8O7
C6H5Na3O7

ChemIDplus ID 000320774

Source ChemIDplus

LinkUrl http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1198