Summary

IMPPAT Phytochemical identifier: IMPHY009788

Phytochemical name: alpha-Ketoglutarate

Synonymous chemical names:
α-ketoglutaric acid

External chemical identifiers:
CID:164533, ChEBI:16810

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Chemical structure information

SMILES:
[O-]C(=O)CCC(=O)C(=O)[O-]

InChI:
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)/p-2

InChIKey:
KPGXRSRHYNQIFN-UHFFFAOYSA-L

DeepSMILES:
[O-]C=O)CCC=O)C=O)[O-]

Functional groups:
CC(=O)C(=O)[O-], CC(=O)[O-]

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Keto acids and derivatives

ClassyFire Subclass: Gamma-keto acids and derivatives

NP-Likeness score: -0.074

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Chemical structure download