Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018003

Phytochemical name: 6-Ethyl-2-methyldecane

Synonymous chemical names:
6-Ethyl-2-methyldecane

External chemical identifiers:
CID:CID_43923

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Chemical structure information

SMILES:
CCCCC(CCCC(C)C)CC

InChI:
InChI=1S/C13H28/c1-5-7-10-13(6-2)11-8-9-12(3)4/h12-13H,5-11H2,1-4H3

InChIKey:
URCFDWVAWCRKTQ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC)C)))))CC

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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: 0.816

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Chemical structure download