Summary

IMPPAT Phytochemical identifier: IMPHY015331

Phytochemical name: 3-Ethyl-1,5-octadiene

Synonymous chemical names:
3-ethyl-1,5-octadiene

External chemical identifiers:
CID:5353002, SureChEMBL:SCHEMBL22685857

---

Chemical structure information

SMILES:
CC/C=C/CC(C=C)CC

InChI:
InChI=1S/C10H18/c1-4-7-8-9-10(5-2)6-3/h5,7-8,10H,2,4,6,9H2,1,3H3/b8-7+

InChIKey:
DXYBMKOHVHUXNV-BQYQJAHWSA-N

DeepSMILES:
CC/C=C/CCC=C))CC

Functional groups:
C/C=C/C, C=CC

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Olefins

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols, Hydrocarbons

NP-Likeness score: 2.143

---

Chemical structure download