Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID017634

Phytochemical name: 1-Pentacosanol

Synonymous chemical names:
pentacosyl alcohol

External chemical identifiers:
CID:CID_92247, ChEBI:CHEBI:78427, ZINC:ZINC000086040206, FDASRS:NA66I0JFTI, SureChEMBL:SCHEMBL377815

---

Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCO

InChI:
InChI=1S/C25H52O/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/h26H,2-25H2,1H3

InChIKey:
IACKKVBKKNJZGN-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCO

Functional groups:
CO

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 0.289

---

Chemical structure download