Summary

IMPPAT Phytochemical identifier: IMPHY012245

Phytochemical name: 1,8-Nonadiene

Synonymous chemical names:
1-8, nonadiene

External chemical identifiers:
CID:78612, ZINC:ZINC000002568009, SureChEMBL:SCHEMBL23196

---

Chemical structure information

SMILES:
C=CCCCCCC=C

InChI:
InChI=1S/C9H16/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-9H2

InChIKey:
VJHGSLHHMIELQD-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCC=C

Functional groups:
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: Hydrocarbons

NP-Likeness score: 0.984

---

Chemical structure download