Summary

IMPPAT Phytochemical identifier: IMPHY015423

Phytochemical name: 5-Propyltridecane

Synonymous chemical names:
5-propyltridecane

External chemical identifiers:
CID:41310, SureChEMBL:SCHEMBL2991307

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Chemical structure information

SMILES:
CCCCCCCCC(CCCC)CCC

InChI:
InChI=1S/C16H34/c1-4-7-9-10-11-12-15-16(13-6-3)14-8-5-2/h16H,4-15H2,1-3H3

InChIKey:
SCMYWAVVKSTDNI-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCC))))CCC

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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: 0.833

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Chemical structure download