Summary

IMPPAT Phytochemical identifier: IMPHY016675

Phytochemical name: 1-Heptacosene

Synonymous chemical names:
heptacosene

External chemical identifiers:
CID:528971, FDASRS:ZQ78CUM5JK, SureChEMBL:SCHEMBL486876

---

Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCC=C

InChI:
InChI=1S/C27H54/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-26-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-27H2,2H3

InChIKey:
YYLACZAXCCJCJO-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCC=C

Functional groups:
C=CC

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Unsaturated aliphatic hydrocarbons

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.376

---

Chemical structure download