Summary

IMPPAT Phytochemical identifier: IMPHY015443

Phytochemical name: 7-n-Propyltridecane

Synonymous chemical names:
7-propyl-tridecane

External chemical identifiers:
CID:246301, ZINC:ZINC000001689501, SureChEMBL:SCHEMBL2592932

---

Chemical structure information

SMILES:
CCCCCCC(CCCCCC)CCC

InChI:
InChI=1S/C16H34/c1-4-7-9-11-14-16(13-6-3)15-12-10-8-5-2/h16H,4-15H2,1-3H3

InChIKey:
VIPXLNQRBDOQFP-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCC))))))CCC

---

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: 0.801

---

Chemical structure download