Summary

IMPPAT Phytochemical identifier: IMPHY017448

Phytochemical name: Docosan-6-ol

Synonymous chemical names:
docosan-6-ol

External chemical identifiers:
CID:54044611, SureChEMBL:SCHEMBL9959127

---

Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCC(CCCCC)O

InChI:
InChI=1S/C22H46O/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-19-21-22(23)20-18-6-4-2/h22-23H,3-21H2,1-2H3

InChIKey:
LOROIRPLTLDBGL-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCC)))))O

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: 0.553

---

Chemical structure download