Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018256

Phytochemical name: Tetradecadien-3-one,1,13-

Synonymous chemical names:
Tetradecadien-3-one,1,13-

External chemical identifiers:
CID:CID_337818

---

Chemical structure information

SMILES:
C=CCCCCCCCCCC(=O)C=C

InChI:
InChI=1S/C14H24O/c1-3-5-6-7-8-9-10-11-12-13-14(15)4-2/h3-4H,1-2,5-13H2

InChIKey:
ALXCRKQLOWBSOZ-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCCCCCC=O)C=C

Functional groups:
C=CC, C=CC(C)=O

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbonyl compounds

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Oxygenated hydrocarbons

NP-Likeness score: 1.2

---

Chemical structure download