Summary

IMPPAT Phytochemical identifier: IMPHY016424

Phytochemical name: 4-Methyldecane

Synonymous chemical names:
4-methyl decane,, 4-methyldecane

External chemical identifiers:
CID:17835, ChEBI:88816, SureChEMBL:SCHEMBL872663

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Chemical structure information

SMILES:
CCCCCCC(CCC)C

InChI:
InChI=1S/C11H24/c1-4-6-7-8-10-11(3)9-5-2/h11H,4-10H2,1-3H3

InChIKey:
DVWZNKLWPILULD-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC)))C

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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: 1.041

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Chemical structure download