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Details

Stereochemistry ACHIRAL
Molecular Formula C6H8O7
Molecular Weight 192.1235
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOCITRIC ACID

SMILES

OC(C(CC(O)=O)C(O)=O)C(O)=O

InChI

InChIKey=ODBLHEXUDAPZAU-UHFFFAOYSA-N
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)

HIDE SMILES / InChI

Molecular Formula C6H8O7
Molecular Weight 192.1235
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
2200.0 µM [Ki]
PubMed

PubMed

TitleDatePubMed
Inhibition of etoposide-induced DNA damage and cytotoxicity in L1210 cells by dehydrogenase inhibitors and other agents.
1984 Feb
[Biosynthesis of isocitric acid by the yeast yarrowia lipolytica and its regulation].
2015 Mar-Apr
Metabolomics analysis of TiO(2) nanoparticles induced toxicological effects on rice (Oryza sativa L.).
2017 Nov
Itaconic acid inhibits growth of a pathogenic marine Vibrio strain: A metabolomics approach.
2019 Apr 11
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:02:35 GMT 2023
Edited
by admin
on Sat Dec 16 08:02:35 GMT 2023
Record UNII
9RW6G5D4MQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOCITRIC ACID
Common Name English
3-CARBOXY-2,3-DIDEOXYPENTARIC ACID
Systematic Name English
DL-ISOCITRIC ACID
Common Name English
Code System Code Type Description
CHEBI
30887
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
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EPA CompTox
DTXSID60861871
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
PRIMARY
ECHA (EC/EINECS)
206-282-3
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
PRIMARY
CHEBI
151
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
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CAS
320-77-4
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
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FDA UNII
9RW6G5D4MQ
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
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DRUG BANK
DB01727
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
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PUBCHEM
1198
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
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WIKIPEDIA
Isocitric acid
Created by admin on Sat Dec 16 08:02:35 GMT 2023 , Edited by admin on Sat Dec 16 08:02:35 GMT 2023
PRIMARY