Summary

IMPPAT Phytochemical identifier: IMPHY006436

Phytochemical name: Octacosanoate

Synonymous chemical names:
octacosanoate

External chemical identifiers:
CID:5461029, ChEBI:31002

---

Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)[O-]

InChI:
InChI=1S/C28H56O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h2-27H2,1H3,(H,29,30)/p-1

InChIKey:
UTOPWMOLSKOLTQ-UHFFFAOYSA-M

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCC=O)[O-]

Functional groups:
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 acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.064

---

Chemical structure download