Summary

IMPPAT Phytochemical identifier: IMPHY004303

Phytochemical name: Icosa-5,8,11,14-tetraenoic acid

Synonymous chemical names:
eicosa-5,8,11,14-tetraenoic acid

External chemical identifiers:
CID:5312542, ChEMBL:CHEMBL267484, ZINC:ZINC000012504416, SureChEMBL:SCHEMBL23768, MolPort-006-169-802

---

Chemical structure information

SMILES:
CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCCC(=O)O

InChI:
InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6+,10-9+,13-12+,16-15+

InChIKey:
YZXBAPSDXZZRGB-CGRWFSSPSA-N

DeepSMILES:
CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCCC=O)O

Functional groups:
C/C=C/C, CC(=O)O

---

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: Unsaturated fatty acids

NP-Likeness score: 1.058

---

Chemical structure download