Summary

IMPPAT Phytochemical identifier: IMPHY012467

Phytochemical name: 2,3-Dihydroxybutanoic acid

Synonymous chemical names:
2,3-dihydroxybutanoic acid

External chemical identifiers:
CID:250402, ChEBI:86347, SureChEMBL:SCHEMBL242912

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Chemical structure information

SMILES:
CC(C(C(=O)O)O)O

InChI:
InChI=1S/C4H8O4/c1-2(5)3(6)4(7)8/h2-3,5-6H,1H3,(H,7,8)

InChIKey:
LOUGYXZSURQALL-UHFFFAOYSA-N

DeepSMILES:
CCCC=O)O))O))O

Functional groups:
CC(=O)O, CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbohydrates and carbohydrate conjugates

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP Classifier Class: Hydroxy fatty acids

NP-Likeness score: 1.205

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Chemical structure download