Summary

IMPPAT Phytochemical identifier: IMPHY017504

Phytochemical name: 1,5,7-Octatrien-3-ol

Synonymous chemical names:
octa-1,5,7-trien-3-ol

External chemical identifiers:
CID:57193976

---

Chemical structure information

SMILES:
C=CC=CCC(C=C)O

InChI:
InChI=1S/C8H12O/c1-3-5-6-7-8(9)4-2/h3-6,8-9H,1-2,7H2

InChIKey:
VDZVLUMVRXPKNF-UHFFFAOYSA-N

DeepSMILES:
C=CC=CCCC=C))O

Functional groups:
C=CC, C=CC=CC, 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: 3.022

---

Chemical structure download