Summary

IMPPAT Phytochemical identifier: IMPHY015414

Phytochemical name: 5-Methylnonane

Synonymous chemical names:
5-methylnonane

External chemical identifiers:
CID:27518, ZINC:ZINC000002564096, SureChEMBL:SCHEMBL56652

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Chemical structure information

SMILES:
CCCCC(CCCC)C

InChI:
InChI=1S/C10H22/c1-4-6-8-10(3)9-7-5-2/h10H,4-9H2,1-3H3

InChIKey:
TYSIILFJZXHVPU-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCC))))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: 0.676

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Chemical structure download