Summary

IMPPAT Phytochemical identifier: IMPHY005953

Phytochemical name: (Z)-8-Dodecen-1-ol acetate

Synonymous chemical names:
z-8-dodecenyl acetate

External chemical identifiers:
CID:5363377, ZINC:ZINC000031333921, FDASRS:0MWD335OTN, SureChEMBL:SCHEMBL408612, MolPort-006-125-474

---

Chemical structure information

SMILES:
CCC/C=CCCCCCCCOC(=O)C

InChI:
InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h5-6H,3-4,7-13H2,1-2H3/b6-5-

InChIKey:
SUCYDSJQVVGOIW-WAYWQWQTSA-N

DeepSMILES:
CCC/C=CCCCCCCCOC=O)C

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

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohol esters

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty esters

NP Classifier Class: Wax monoesters

NP-Likeness score: 1.155

---

Chemical structure download