Summary

IMPPAT Phytochemical identifier: IMPHY010579

Phytochemical name: 1-Eicosene

Synonymous chemical names:
1-eicosene, arachidene, eicos-1-ene, eicosene, eicosene*

External chemical identifiers:
CID:18936, ZINC:ZINC000059629047, FDASRS:6BHH7ZD637, SureChEMBL:SCHEMBL23128, MolPort-003-927-351

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCC=C

InChI:
InChI=1S/C20H40/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3H,1,4-20H2,2H3

InChIKey:
VAMFXQBUQXONLZ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCC=C

Functional groups:
C=CC

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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: 0.508

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Chemical structure download