Summary

IMPPAT Phytochemical identifier: IMPHY016201

Phytochemical name: Eicosane, 10-heptyl-10-octyl-

Synonymous chemical names:
10-heptyl-10-octylicosane

External chemical identifiers:
CID:298665

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Chemical structure information

SMILES:
CCCCCCCCCCC(CCCCCCCCC)(CCCCCCCC)CCCCCCC

InChI:
InChI=1S/C35H72/c1-5-9-13-17-20-22-26-30-34-35(31-27-23-16-12-8-4,32-28-24-19-15-11-7-3)33-29-25-21-18-14-10-6-2/h5-34H2,1-4H3

InChIKey:
FEIFRHBKEQKLTC-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCC)))))))))CCCCCCCC))))))))CCCCCCC

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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: 0.141

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Chemical structure download