Summary

IMPPAT Phytochemical identifier: IMPHY001372

Phytochemical name: 2-Hydroxytetracosanoic acid

Synonymous chemical names:
2-hydroxytetracosanoic acid

External chemical identifiers:
CID:102430, ChEBI:61302, FDASRS:66QN3B074E, SureChEMBL:SCHEMBL338278, MolPort-044-727-775

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCCCC(C(=O)O)O

InChI:
InChI=1S/C24H48O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(25)24(26)27/h23,25H,2-22H2,1H3,(H,26,27)

InChIKey:
MSUOLNSQHLHDAS-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCCCC=O)O))O

Functional groups:
CC(=O)O, CO

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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, Unsaturated fatty acids

NP-Likeness score: 0.581

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Chemical structure download