Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018273

Phytochemical name: 2-Hydroxytetradecanoic acid

Synonymous chemical names:
2-Hydroxytetradecanoic acid

External chemical identifiers:
CID:CID_1563, ChEMBL:CHEMBL2004471, ChEBI:CHEBI:59270, SureChEMBL:SCHEMBL123324, Molport-001-011-666

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Chemical structure information

SMILES:
CCCCCCCCCCCCC(C(=O)O)O

InChI:
InChI=1S/C14H28O3/c1-2-3-4-5-6-7-8-9-10-11-12-13(15)14(16)17/h13,15H,2-12H2,1H3,(H,16,17)

InChIKey:
JYZJYKOZGGEXSX-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCC=O)O))O

Functional groups:
CO, CC(=O)O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty acids and conjugates

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP Classifier Class: Hydroxy fatty acids

NP-Likeness score: 0.923

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Chemical structure download