Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID000345

Phytochemical name: Eicosane

Synonymous chemical names:
eicosane*, n-eicosane*, eicosane (c20), eicosane, n, n-eicosane, Eicosane, icosane, eicosane, eciosane

External chemical identifiers:
CID:CID_8222, ChEBI:CHEBI:43619, ZINC:ZINC000015638542, FDASRS:3AYA9KEC48, SureChEMBL:SCHEMBL78397, MolPort-003-928-001

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCC

InChI:
InChI=1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3

InChIKey:
CBFCDTFDPHXCNY-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCC

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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: 0.122

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Chemical structure download