Summary

IMPPAT Phytochemical identifier: IMPHY009369

Phytochemical name: Nonadecane

Synonymous chemical names:
n-nonadecane, n-nonadecane*, nonadecane, nonadecane , nonadecane*, nonadecane, n

External chemical identifiers:
CID:12401, ChEBI:32927, ZINC:ZINC000008398603, FDASRS:NMY21D3Y5T, SureChEMBL:SCHEMBL100529, MolPort-002-351-165

---

Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCC

InChI:
InChI=1S/C19H40/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3-19H2,1-2H3

InChIKey:
LQERIDTXQFOHKA-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCC

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Saturated hydrocarbons

ClassyFire Subclass: Alkanes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.129

---

Chemical structure download

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT